compound_id
string | SMILES
string | toxicity_SR-MMP
int64 | split
string | SMILES_ORIGINAL
string | IMAGE
image | SELFIES
string | InChIKey
string | IUPAC
string | template_original
string | template
string |
|---|---|---|---|---|---|---|---|---|---|---|
TOX7581 | C1=CCCC=CCCC=CCC1 | 0 | train | C1=CCCC=CCCC=CCC1 | [C][=C][C][C][C][=C][C][C][C][=C][C][C][Ring1][N] | ZOLLIQAKMYWTBR-UHFFFAOYSA-N | cyclododeca-1,5,9-triene | Task: Please answer the multiple choice question.
Question: Is the molecule with the {SMILES__description} {#representation of |!}{SMILES#} {toxicity_SR-MMP__names__adjective}?
Constraint: Even if you are {#uncertain|not sure!}, you must pick either {%multiple_choice_enum%2%aA1} without using any {#other|additional!} words.
Options:
{toxicity_SR-MMP%}
Answer: {%multiple_choice_result} | Task: Please answer the multiple choice question.
Question: Is the molecule with the SMILES representation of C1=CCCC=CCCC=CCC1 toxic in the SR-Mitochondrial membrane potential assay?
Constraint: Even if you are uncertain, you must pick either a or b without using any additional words.
Options:
[a] False
[b] True
Answer: a |
|
TOX27287 | COCc1nnc(-c2ccc[n+]([O-])c2)n1-c1c(Cl)c(Cl)cc2[nH]c(=O)c(=O)[nH]c12 | 0 | train | COCc1nnc(-c2ccc[n+]([O-])c2)n1-c1c(Cl)c(Cl)cc2[nH]c(=O)c(=O)[nH]c12 | [C][O][C][C][=N][N][=C][Branch1][N][C][=C][C][=C][N+1][Branch1][C][O-1][=C][Ring1][#Branch1][N][Ring1][N][C][=C][Branch1][C][Cl][C][Branch1][C][Cl][=C][C][NH1][C][=Branch1][C][=O][C][=Branch1][C][=O][NH1][C][Ring1][=C][=Ring1][Branch2] | IEMAQDHGZOPMNI-UHFFFAOYSA-N | 6,7-dichloro-5-[3-(methoxymethyl)-5-(1-oxidopyridin-1-ium-3-yl)-1,2,4-triazol-4-yl]-1,4-dihydroquinoxaline-2,3-dione | Task: Please answer the multiple choice question.
Question: Is the molecule with the {SMILES__description} {#representation of |!}{SMILES#} {toxicity_SR-MMP__names__adjective}?
Constraint: Even if you are {#uncertain|not sure!}, you must pick either {%multiple_choice_enum%2%aA1} without using any {#other|additional!} words.
Options:
{toxicity_SR-MMP%}
Answer: {%multiple_choice_result} | Task: Please answer the multiple choice question.
Question: Is the molecule with the SMILES representation of COCc1nnc(-c2ccc[n+]([O-])c2)n1-c1c(Cl)c(Cl)cc2[nH]c(=O)c(=O)[nH]c12 toxic in the Mitochondrial membrane potential assay?
Constraint: Even if you are not sure, you must pick either a or b without using any other words.
Options:
a. True
b. False
Answer: b |
|
TOX1816 | C=CCOC(=O)C(=C)C | 0 | train | C=CCOC(=O)C(=C)C | [C][=C][C][O][C][=Branch1][C][=O][C][=Branch1][C][=C][C] | FBCQUCJYYPMKRO-UHFFFAOYSA-N | 2-methyl-3-prop-2-enoxyprop-1-en-3-one | Task: Please answer the multiple choice question.
Question: Is the molecule with the {SMILES__description} {#representation of |!}{SMILES#} {toxicity_SR-MMP__names__adjective}?
Constraint: Even if you are {#uncertain|not sure!}, you must pick either {%multiple_choice_enum%2%aA1} without using any {#other|additional!} words.
Options:
{toxicity_SR-MMP%}
Answer: {%multiple_choice_result} | Task: Please answer the multiple choice question.
Question: Is the molecule with the SMILES representation of C=CCOC(=O)C(=C)C toxic in the SR-MMP assay?
Constraint: Even if you are uncertain, you must pick either a or b without using any additional words.
Options:
(a) True
(b) False
Answer: b |
|
TOX7595 | CCCCCCCCS(=O)(=O)[O-] | 0 | train | CCCCCCCCS(=O)(=O)[O-] | [C][C][C][C][C][C][C][C][S][=Branch1][C][=O][=Branch1][C][=O][O-1] | WLGDAKIJYPIYLR-UHFFFAOYSA-M | octane-1-sulfonate | Task: Please answer the multiple choice question.
Question: Is the molecule with the {SMILES__description} {#representation of |!}{SMILES#} {toxicity_SR-MMP__names__adjective}?
Constraint: Even if you are {#uncertain|not sure!}, you must pick either {%multiple_choice_enum%2%aA1} without using any {#other|additional!} words.
Options:
{toxicity_SR-MMP%}
Answer: {%multiple_choice_result} | Task: Please answer the multiple choice question.
Question: Is the molecule with the SMILES CCCCCCCCS(=O)(=O)[O-] toxic in the SR-Mitochondrial membrane potential assay?
Constraint: Even if you are uncertain, you must pick either a or b without using any other words.
Options:
a. False
b. True
Answer: a |
|
TOX13896 | ClP(Cl)(Cl)(Cl)Cl | 0 | train | ClP(Cl)(Cl)(Cl)Cl | [Cl][P][Branch1][C][Cl][Branch1][C][Cl][Branch1][C][Cl][Cl] | UHZYTMXLRWXGPK-UHFFFAOYSA-N | pentachloro-λ5-phosphane | Task: Please answer the multiple choice question.
Question: Is the molecule with the {SMILES__description} {#representation of |!}{SMILES#} {toxicity_SR-MMP__names__adjective}?
Constraint: Even if you are {#uncertain|not sure!}, you must pick either {%multiple_choice_enum%2%aA1} without using any {#other|additional!} words.
Options:
{toxicity_SR-MMP%}
Answer: {%multiple_choice_result} | Task: Please answer the multiple choice question.
Question: Is the molecule with the SMILES representation of ClP(Cl)(Cl)(Cl)Cl toxic in the SR-Mitochondrial membrane potential assay?
Constraint: Even if you are uncertain, you must pick either a or b without using any other words.
Options:
a.) True
b.) False
Answer: b |
|
TOX777 | CC(C)(C)NC[C@H](O)COc1cccc2c1CCCC2=O | 0 | train | CC(C)(C)NC[C@H](O)COc1cccc2c1CCCC2=O | [C][C][Branch1][C][C][Branch1][C][C][N][C][C@H1][Branch1][C][O][C][O][C][=C][C][=C][C][=C][Ring1][=Branch1][C][C][C][C][Ring1][=Branch1][=O] | IXHBTMCLRNMKHZ-LBPRGKRZSA-N | 5-[(2S)-3-(tert-butylamino)-2-hydroxypropoxy]-3,4-dihydro-2H-naphthalen-1-one | Task: Please answer the multiple choice question.
Question: Is the molecule with the {SMILES__description} {#representation of |!}{SMILES#} {toxicity_SR-MMP__names__adjective}?
Constraint: Even if you are {#uncertain|not sure!}, you must pick either {%multiple_choice_enum%2%aA1} without using any {#other|additional!} words.
Options:
{toxicity_SR-MMP%}
Answer: {%multiple_choice_result} | Task: Please answer the multiple choice question.
Question: Is the molecule with the SMILES CC(C)(C)NC[C@H](O)COc1cccc2c1CCCC2=O toxic in the SR-MMP assay?
Constraint: Even if you are uncertain, you must pick either a or b without using any additional words.
Options:
(a) False
(b) True
Answer: a |
|
TOX26925 | C[N+]1(CC2COC(c3ccccc3)(C3CCCCC3)O2)CCCCC1 | 0 | train | C[N+]1(CC2COC(c3ccccc3)(C3CCCCC3)O2)CCCCC1 | [C][N+1][Branch2][Ring1][=N][C][C][C][O][C][Branch1][=Branch2][C][=C][C][=C][C][=C][Ring1][=Branch1][Branch1][=Branch2][C][C][C][C][C][C][Ring1][=Branch1][O][Ring1][P][C][C][C][C][C][Ring2][Ring1][Branch2] | AXWZZEWIGNYBGA-UHFFFAOYSA-N | 1-[(2-cyclohexa-2,4,6-trien-1-yl-2-cyclohexyl-1,3-dioxolan-4-yl)methyl]-1-methylpiperidin-1-ium | Task: Please answer the multiple choice question.
Question: Is the molecule with the {SMILES__description} {#representation of |!}{SMILES#} {toxicity_SR-MMP__names__adjective}?
Constraint: Even if you are {#uncertain|not sure!}, you must pick either {%multiple_choice_enum%2%aA1} without using any {#other|additional!} words.
Options:
{toxicity_SR-MMP%}
Answer: {%multiple_choice_result} | Task: Please answer the multiple choice question.
Question: Is the molecule with the SMILES representation of C[N+]1(CC2COC(c3ccccc3)(C3CCCCC3)O2)CCCCC1 toxic in the SR-MMP assay?
Constraint: Even if you are not sure, you must pick either a or b without using any additional words.
Options:
a. True
b. False
Answer: b |
|
TOX22060 | CC1(C)[C@@H]2CC[C@@]1(C)[C@H](O)C2 | 0 | train | CC1(C)[C@@H]2CC[C@@]1(C)[C@H](O)C2 | [C][C][Branch1][C][C][C@@H1][C][C][C@@][Ring1][=Branch1][Branch1][C][C][C@H1][Branch1][C][O][C][Ring1][Branch2] | DTGKSKDOIYIVQL-MRTMQBJTSA-N | (1R,2R,4R)-1,7,7-trimethylbicyclo[2.2.1]heptan-2-ol | Task: Please answer the multiple choice question.
Question: Is the molecule with the {SMILES__description} {#representation of |!}{SMILES#} {toxicity_SR-MMP__names__adjective}?
Constraint: Even if you are {#uncertain|not sure!}, you must pick either {%multiple_choice_enum%2%aA1} without using any {#other|additional!} words.
Options:
{toxicity_SR-MMP%}
Answer: {%multiple_choice_result} | Task: Please answer the multiple choice question.
Question: Is the molecule with the SMILES representation of CC1(C)[C@@H]2CC[C@@]1(C)[C@H](O)C2 toxic in the SR-MMP assay?
Constraint: Even if you are not sure, you must pick either a or b without using any other words.
Options:
a: False
b: True
Answer: a |
|
TOX44 | C=CCO | 0 | train | C=CCO | [C][=C][C][O] | XXROGKLTLUQVRX-UHFFFAOYSA-N | prop-2-en-1-ol | Task: Please answer the multiple choice question.
Question: Is the molecule with the {SMILES__description} {#representation of |!}{SMILES#} {toxicity_SR-MMP__names__adjective}?
Constraint: Even if you are {#uncertain|not sure!}, you must pick either {%multiple_choice_enum%2%aA1} without using any {#other|additional!} words.
Options:
{toxicity_SR-MMP%}
Answer: {%multiple_choice_result} | Task: Please answer the multiple choice question.
Question: Is the molecule with the SMILES C=CCO toxic in the SR-MMP assay?
Constraint: Even if you are uncertain, you must pick either a or b without using any additional words.
Options:
a True
b False
Answer: b |
|
TOX27053 | CC1=CC[C@H](C(C)C)C=C1 | 0 | train | CC1=CC[C@H](C(C)C)C=C1 | [C][C][=C][C][C@H1][Branch1][=Branch1][C][Branch1][C][C][C][C][=C][Ring1][=Branch2] | OGLDWXZKYODSOB-SNVBAGLBSA-N | (5R)-2-methyl-5-propan-2-ylcyclohexa-1,3-diene | Task: Please answer the multiple choice question.
Question: Is the molecule with the {SMILES__description} {#representation of |!}{SMILES#} {toxicity_SR-MMP__names__adjective}?
Constraint: Even if you are {#uncertain|not sure!}, you must pick either {%multiple_choice_enum%2%aA1} without using any {#other|additional!} words.
Options:
{toxicity_SR-MMP%}
Answer: {%multiple_choice_result} | Task: Please answer the multiple choice question.
Question: Is the molecule with the SMILES CC1=CC[C@H](C(C)C)C=C1 toxic in the SR-Mitochondrial membrane potential assay?
Constraint: Even if you are uncertain, you must pick either a or b without using any other words.
Options:
(a) True
(b) False
Answer: b |
|
TOX2008 | CCCCCCCCCO | 0 | train | CCCCCCCCCO | [C][C][C][C][C][C][C][C][C][O] | ZWRUINPWMLAQRD-UHFFFAOYSA-N | nonan-1-ol | Task: Please answer the multiple choice question.
Question: Is the molecule with the {SMILES__description} {#representation of |!}{SMILES#} {toxicity_SR-MMP__names__adjective}?
Constraint: Even if you are {#uncertain|not sure!}, you must pick either {%multiple_choice_enum%2%aA1} without using any {#other|additional!} words.
Options:
{toxicity_SR-MMP%}
Answer: {%multiple_choice_result} | Task: Please answer the multiple choice question.
Question: Is the molecule with the SMILES CCCCCCCCCO toxic in the SR-MMP assay?
Constraint: Even if you are not sure, you must pick either a or b without using any additional words.
Options:
a.) True
b.) False
Answer: b |
|
TOX5501 | CC1CCC(C(C)CS)CC1S | 0 | train | CC1CCC(C(C)CS)CC1S | [C][C][C][C][C][Branch1][#Branch1][C][Branch1][C][C][C][S][C][C][Ring1][#Branch2][S] | SUNXFMPZAFGPFW-UHFFFAOYSA-N | 2-methyl-5-(1-sulfanylpropan-2-yl)cyclohexane-1-thiol | Task: Please answer the multiple choice question.
Question: Is the molecule with the {SMILES__description} {#representation of |!}{SMILES#} {toxicity_SR-MMP__names__adjective}?
Constraint: Even if you are {#uncertain|not sure!}, you must pick either {%multiple_choice_enum%2%aA1} without using any {#other|additional!} words.
Options:
{toxicity_SR-MMP%}
Answer: {%multiple_choice_result} | Task: Please answer the multiple choice question.
Question: Is the molecule with the SMILES CC1CCC(C(C)CS)CC1S toxic in the Mitochondrial membrane potential assay?
Constraint: Even if you are uncertain, you must pick either a or b without using any other words.
Options:
a.) True
b.) False
Answer: b |
|
TOX14669 | C#CCN1CC(=O)N(COC(=O)[C@@H]2[C@@H](C=C(C)C)C2(C)C)C1=O | 0 | train | C#CCN1CC(=O)N(COC(=O)[C@@H]2[C@@H](C=C(C)C)C2(C)C)C1=O | [C][#C][C][N][C][C][=Branch1][C][=O][N][Branch2][Ring1][Branch2][C][O][C][=Branch1][C][=O][C@@H1][C@@H1][Branch1][#Branch1][C][=C][Branch1][C][C][C][C][Ring1][#Branch1][Branch1][C][C][C][C][Ring2][Ring1][Ring1][=O] | VPRAQYXPZIFIOH-OCCSQVGLSA-N | (2,5-dioxo-3-prop-2-ynylimidazolidin-1-yl)methyl (1R,3R)-2,2-dimethyl-3-(2-methylprop-1-enyl)cyclopropane-1-carboxylate | Task: Please answer the multiple choice question.
Question: Is the molecule with the {SMILES__description} {#representation of |!}{SMILES#} {toxicity_SR-MMP__names__adjective}?
Constraint: Even if you are {#uncertain|not sure!}, you must pick either {%multiple_choice_enum%2%aA1} without using any {#other|additional!} words.
Options:
{toxicity_SR-MMP%}
Answer: {%multiple_choice_result} | Task: Please answer the multiple choice question.
Question: Is the molecule with the SMILES representation of C#CCN1CC(=O)N(COC(=O)[C@@H]2[C@@H](C=C(C)C)C2(C)C)C1=O toxic in the Mitochondrial membrane potential assay?
Constraint: Even if you are not sure, you must pick either a or b without using any additional words.
Options:
a. False
b. True
Answer: a |
|
TOX1874 | CCCBr | 0 | train | CCCBr | [C][C][C][Br] | CYNYIHKIEHGYOZ-UHFFFAOYSA-N | 1-bromopropane | Task: Please answer the multiple choice question.
Question: Is the molecule with the {SMILES__description} {#representation of |!}{SMILES#} {toxicity_SR-MMP__names__adjective}?
Constraint: Even if you are {#uncertain|not sure!}, you must pick either {%multiple_choice_enum%2%aA1} without using any {#other|additional!} words.
Options:
{toxicity_SR-MMP%}
Answer: {%multiple_choice_result} | Task: Please answer the multiple choice question.
Question: Is the molecule with the SMILES CCCBr toxic in the SR-MMP assay?
Constraint: Even if you are uncertain, you must pick either a or b without using any additional words.
Options:
(a) True
(b) False
Answer: b |
|
TOX6998 | CC(C)CC(=O)CC(C)CC(C)C | 0 | train | CC(C)CC(=O)CC(C)CC(C)C | [C][C][Branch1][C][C][C][C][=Branch1][C][=O][C][C][Branch1][C][C][C][C][Branch1][C][C][C] | GFWVDQCGGDBTBS-UHFFFAOYSA-N | 2,6,8-trimethylnonan-4-one | Task: Please answer the multiple choice question.
Question: Is the molecule with the {SMILES__description} {#representation of |!}{SMILES#} {toxicity_SR-MMP__names__adjective}?
Constraint: Even if you are {#uncertain|not sure!}, you must pick either {%multiple_choice_enum%2%aA1} without using any {#other|additional!} words.
Options:
{toxicity_SR-MMP%}
Answer: {%multiple_choice_result} | Task: Please answer the multiple choice question.
Question: Is the molecule with the SMILES CC(C)CC(=O)CC(C)CC(C)C toxic in the Mitochondrial membrane potential assay?
Constraint: Even if you are not sure, you must pick either a or b without using any other words.
Options:
a.) False
b.) True
Answer: a |
|
TOX7764 | CCCCCCCCCC(=O)N(C)C | 0 | train | CCCCCCCCCC(=O)N(C)C | [C][C][C][C][C][C][C][C][C][C][=Branch1][C][=O][N][Branch1][C][C][C] | HNXNKTMIVROLTK-UHFFFAOYSA-N | N,N-dimethyldecanamide | Task: Please answer the multiple choice question.
Question: Is the molecule with the {SMILES__description} {#representation of |!}{SMILES#} {toxicity_SR-MMP__names__adjective}?
Constraint: Even if you are {#uncertain|not sure!}, you must pick either {%multiple_choice_enum%2%aA1} without using any {#other|additional!} words.
Options:
{toxicity_SR-MMP%}
Answer: {%multiple_choice_result} | Task: Please answer the multiple choice question.
Question: Is the molecule with the SMILES CCCCCCCCCC(=O)N(C)C toxic in the SR-MMP assay?
Constraint: Even if you are uncertain, you must pick either a or b without using any additional words.
Options:
(a) True
(b) False
Answer: b |
|
TOX25891 | CC(N)CCCC(C)(C)O | 0 | train | CC(N)CCCC(C)(C)O | [C][C][Branch1][C][N][C][C][C][C][Branch1][C][C][Branch1][C][C][O] | LREQLEBVOXIEOM-UHFFFAOYSA-N | 6-amino-2-methylheptan-2-ol | Task: Please answer the multiple choice question.
Question: Is the molecule with the {SMILES__description} {#representation of |!}{SMILES#} {toxicity_SR-MMP__names__adjective}?
Constraint: Even if you are {#uncertain|not sure!}, you must pick either {%multiple_choice_enum%2%aA1} without using any {#other|additional!} words.
Options:
{toxicity_SR-MMP%}
Answer: {%multiple_choice_result} | Task: Please answer the multiple choice question.
Question: Is the molecule with the SMILES CC(N)CCCC(C)(C)O toxic in the Mitochondrial membrane potential assay?
Constraint: Even if you are not sure, you must pick either a or b without using any additional words.
Options:
a) False
b) True
Answer: a |
|
TOX1415 | CC(O)CN(CC(C)O)CC(C)O | 0 | train | CC(O)CN(CC(C)O)CC(C)O | [C][C][Branch1][C][O][C][N][Branch1][#Branch1][C][C][Branch1][C][C][O][C][C][Branch1][C][C][O] | SLINHMUFWFWBMU-UHFFFAOYSA-N | 1-[bis(2-hydroxypropyl)amino]propan-2-ol | Task: Please answer the multiple choice question.
Question: Is the molecule with the {SMILES__description} {#representation of |!}{SMILES#} {toxicity_SR-MMP__names__adjective}?
Constraint: Even if you are {#uncertain|not sure!}, you must pick either {%multiple_choice_enum%2%aA1} without using any {#other|additional!} words.
Options:
{toxicity_SR-MMP%}
Answer: {%multiple_choice_result} | Task: Please answer the multiple choice question.
Question: Is the molecule with the SMILES CC(O)CN(CC(C)O)CC(C)O toxic in the Mitochondrial membrane potential assay?
Constraint: Even if you are uncertain, you must pick either a or b without using any additional words.
Options:
[a] True
[b] False
Answer: b |
|
TOX7870 | CCCCCCCCCCC=CC1CC(=O)OC1=O | 0 | train | CCCCCCCCCCC=CC1CC(=O)OC1=O | [C][C][C][C][C][C][C][C][C][C][C][=C][C][C][C][=Branch1][C][=O][O][C][Ring1][=Branch1][=O] | WVRNUXJQQFPNMN-UHFFFAOYSA-N | 3-dodec-1-enyloxolane-2,5-dione | Task: Please answer the multiple choice question.
Question: Is the molecule with the {SMILES__description} {#representation of |!}{SMILES#} {toxicity_SR-MMP__names__adjective}?
Constraint: Even if you are {#uncertain|not sure!}, you must pick either {%multiple_choice_enum%2%aA1} without using any {#other|additional!} words.
Options:
{toxicity_SR-MMP%}
Answer: {%multiple_choice_result} | Task: Please answer the multiple choice question.
Question: Is the molecule with the SMILES CCCCCCCCCCC=CC1CC(=O)OC1=O toxic in the SR-MMP assay?
Constraint: Even if you are uncertain, you must pick either a or b without using any additional words.
Options:
a True
b False
Answer: b |
|
TOX25967 | O=C1c2c(O)cccc2[C@H]([C@@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O)c2cc(CO)cc(O)c21 | 0 | train | O=C1c2c(O)cccc2[C@H]([C@@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O)c2cc(CO)cc(O)c21 | [O][=C][C][=C][Branch1][C][O][C][=C][C][=C][Ring1][#Branch1][C@H1][Branch2][Ring1][Ring2][C@@H1][O][C@H1][Branch1][Ring1][C][O][C@@H1][Branch1][C][O][C@H1][Branch1][C][O][C@H1][Ring1][#Branch2][O][C][=C][C][Branch1][Ring1][C][O][=C][C][Branch1][C][O][=C][Ring1][=Branch2][Ring2][Ring1][=N] | AFHJQYHRLPMKHU-OSYMLPPYSA-N | (10S)-1,8-dihydroxy-3-(hydroxymethyl)-10-[(2S,3R,4R,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]-10H-anthracen-9-one | Task: Please answer the multiple choice question.
Question: Is the molecule with the {SMILES__description} {#representation of |!}{SMILES#} {toxicity_SR-MMP__names__adjective}?
Constraint: Even if you are {#uncertain|not sure!}, you must pick either {%multiple_choice_enum%2%aA1} without using any {#other|additional!} words.
Options:
{toxicity_SR-MMP%}
Answer: {%multiple_choice_result} | Task: Please answer the multiple choice question.
Question: Is the molecule with the SMILES representation of O=C1c2c(O)cccc2[C@H]([C@@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O)c2cc(CO)cc(O)c21 toxic in the SR-MMP assay?
Constraint: Even if you are uncertain, you must pick either a or b without using any additional words.
Options:
a: False
b: True
Answer: a |
|
TOX4881 | O=C1C=CCCC1 | 0 | train | O=C1C=CCCC1 | [O][=C][C][=C][C][C][C][Ring1][=Branch1] | FWFSEYBSWVRWGL-UHFFFAOYSA-N | cyclohex-2-en-1-one | Task: Please answer the multiple choice question.
Question: Is the molecule with the {SMILES__description} {#representation of |!}{SMILES#} {toxicity_SR-MMP__names__adjective}?
Constraint: Even if you are {#uncertain|not sure!}, you must pick either {%multiple_choice_enum%2%aA1} without using any {#other|additional!} words.
Options:
{toxicity_SR-MMP%}
Answer: {%multiple_choice_result} | Task: Please answer the multiple choice question.
Question: Is the molecule with the SMILES O=C1C=CCCC1 toxic in the SR-Mitochondrial membrane potential assay?
Constraint: Even if you are not sure, you must pick either a or b without using any additional words.
Options:
a. True
b. False
Answer: b |
|
TOX21416 | CCC(CC)CO | 0 | train | CCC(CC)CO | [C][C][C][Branch1][Ring1][C][C][C][O] | TZYRSLHNPKPEFV-UHFFFAOYSA-N | 2-ethylbutan-1-ol | Task: Please answer the multiple choice question.
Question: Is the molecule with the {SMILES__description} {#representation of |!}{SMILES#} {toxicity_SR-MMP__names__adjective}?
Constraint: Even if you are {#uncertain|not sure!}, you must pick either {%multiple_choice_enum%2%aA1} without using any {#other|additional!} words.
Options:
{toxicity_SR-MMP%}
Answer: {%multiple_choice_result} | Task: Please answer the multiple choice question.
Question: Is the molecule with the SMILES representation of CCC(CC)CO toxic in the SR-MMP assay?
Constraint: Even if you are uncertain, you must pick either a or b without using any additional words.
Options:
a: False
b: True
Answer: a |
|
TOX23908 | CC(C=O)Cc1ccc2c(c1)OCO2 | 0 | train | CC(C=O)Cc1ccc2c(c1)OCO2 | [C][C][Branch1][Ring1][C][=O][C][C][=C][C][=C][C][=Branch1][Ring2][=C][Ring1][=Branch1][O][C][O][Ring1][=Branch1] | BOPPSUHPZARXTH-UHFFFAOYSA-N | 3-(1,3-benzodioxol-5-yl)-2-methylpropanal | Task: Please answer the multiple choice question.
Question: Is the molecule with the {SMILES__description} {#representation of |!}{SMILES#} {toxicity_SR-MMP__names__adjective}?
Constraint: Even if you are {#uncertain|not sure!}, you must pick either {%multiple_choice_enum%2%aA1} without using any {#other|additional!} words.
Options:
{toxicity_SR-MMP%}
Answer: {%multiple_choice_result} | Task: Please answer the multiple choice question.
Question: Is the molecule with the SMILES representation of CC(C=O)Cc1ccc2c(c1)OCO2 toxic in the Mitochondrial membrane potential assay?
Constraint: Even if you are uncertain, you must pick either a or b without using any other words.
Options:
a. False
b. True
Answer: a |
|
TOX332 | O=C(O)CC(O)(CC(=O)O)C(=O)O | 0 | train | O=C(O)CC(O)(CC(=O)O)C(=O)O | [O][=C][Branch1][C][O][C][C][Branch1][C][O][Branch1][#Branch1][C][C][=Branch1][C][=O][O][C][=Branch1][C][=O][O] | KRKNYBCHXYNGOX-UHFFFAOYSA-N | 2-hydroxypropane-1,2,3-tricarboxylicacid | Task: Please answer the multiple choice question.
Question: Is the molecule with the {SMILES__description} {#representation of |!}{SMILES#} {toxicity_SR-MMP__names__adjective}?
Constraint: Even if you are {#uncertain|not sure!}, you must pick either {%multiple_choice_enum%2%aA1} without using any {#other|additional!} words.
Options:
{toxicity_SR-MMP%}
Answer: {%multiple_choice_result} | Task: Please answer the multiple choice question.
Question: Is the molecule with the SMILES O=C(O)CC(O)(CC(=O)O)C(=O)O toxic in the Mitochondrial membrane potential assay?
Constraint: Even if you are not sure, you must pick either a or b without using any additional words.
Options:
a) True
b) False
Answer: b |
|
TOX13512 | C[C@]1(O)CC[C@H]2[C@@H]3CCC4=CC(=O)CC[C@]4(C)[C@@]3(F)[C@@H](O)C[C@@]21C | 0 | train | C[C@]1(O)CC[C@H]2[C@@H]3CCC4=CC(=O)CC[C@]4(C)[C@@]3(F)[C@@H](O)C[C@@]21C | [C][C@][Branch1][C][O][C][C][C@H1][C@@H1][C][C][C][=C][C][=Branch1][C][=O][C][C][C@][Ring1][#Branch1][Branch1][C][C][C@@][Ring1][N][Branch1][C][F][C@@H1][Branch1][C][O][C][C@@][Ring2][Ring1][C][Ring2][Ring1][=Branch1][C] | YLRFCQOZQXIBAB-RBZZARIASA-N | (8S,9R,10S,11S,13S,14S,17S)-9-fluoro-11,17-dihydroxy-10,13,17-trimethyl-1,2,6,7,8,11,12,14,15,16-decahydrocyclopenta[a]phenanthren-3-one | Task: Please answer the multiple choice question.
Question: Is the molecule with the {SMILES__description} {#representation of |!}{SMILES#} {toxicity_SR-MMP__names__adjective}?
Constraint: Even if you are {#uncertain|not sure!}, you must pick either {%multiple_choice_enum%2%aA1} without using any {#other|additional!} words.
Options:
{toxicity_SR-MMP%}
Answer: {%multiple_choice_result} | Task: Please answer the multiple choice question.
Question: Is the molecule with the SMILES C[C@]1(O)CC[C@H]2[C@@H]3CCC4=CC(=O)CC[C@]4(C)[C@@]3(F)[C@@H](O)C[C@@]21C toxic in the SR-Mitochondrial membrane potential assay?
Constraint: Even if you are uncertain, you must pick either a or b without using any additional words.
Options:
a) True
b) False
Answer: b |
|
TOX12683 | COC(=O)/C=C(\C)OP(=O)(OC)OC | 0 | train | COC(=O)/C=C(\C)OP(=O)(OC)OC | [C][O][C][=Branch1][C][=O][/C][=C][Branch1][C][\C][O][P][=Branch1][C][=O][Branch1][Ring1][O][C][O][C] | GEPDYQSQVLXLEU-AATRIKPKSA-N | methyl(E)-3-dimethoxyphosphoryloxybut-2-enoate | Task: Please answer the multiple choice question.
Question: Is the molecule with the {SMILES__description} {#representation of |!}{SMILES#} {toxicity_SR-MMP__names__adjective}?
Constraint: Even if you are {#uncertain|not sure!}, you must pick either {%multiple_choice_enum%2%aA1} without using any {#other|additional!} words.
Options:
{toxicity_SR-MMP%}
Answer: {%multiple_choice_result} | Task: Please answer the multiple choice question.
Question: Is the molecule with the SMILES representation of COC(=O)/C=C(\C)OP(=O)(OC)OC toxic in the Mitochondrial membrane potential assay?
Constraint: Even if you are uncertain, you must pick either a or b without using any additional words.
Options:
a: False
b: True
Answer: a |
|
TOX26008 | CC(C)C[C@@H]1NC(=O)[C@H](CCCN)NC(=O)[C@H](C(C)C)NC(=O)[C@@H]2CCCN2C(=O)[C@@H](Cc2ccccc2)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CCCN)NC(=O)[C@H](C(C)C)NC(=O)[C@@H]2CCCN2C(=O)[C@@H](Cc2ccccc2)NC1=O | 1 | train | CC(C)C[C@@H]1NC(=O)[C@H](CCCN)NC(=O)[C@H](C(C)C)NC(=O)[C@@H]2CCCN2C(=O)[C@@H](Cc2ccccc2)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CCCN)NC(=O)[C@H](C(C)C)NC(=O)[C@@H]2CCCN2C(=O)[C@@H](Cc2ccccc2)NC1=O | [C][C][Branch1][C][C][C][C@@H1][N][C][=Branch1][C][=O][C@H1][Branch1][Branch1][C][C][C][N][N][C][=Branch1][C][=O][C@H1][Branch1][=Branch1][C][Branch1][C][C][C][N][C][=Branch1][C][=O][C@@H1][C][C][C][N][Ring1][Branch1][C][=Branch1][C][=O][C@@H1][Branch1][#Branch2][C][C][=C][C][=C][C][=C][Ring1][=Branch1][N][C][=Branch1][C][=O][C@H1][Branch1][#Branch1][C][C][Branch1][C][C][C][N][C][=Branch1][C][=O][C@H1][Branch1][Branch1][C][C][C][N][N][C][=Branch1][C][=O][C@H1][Branch1][=Branch1][C][Branch1][C][C][C][N][C][=Branch1][C][=O][C@@H1][C][C][C][N][Ring1][Branch1][C][=Branch1][C][=O][C@@H1][Branch1][#Branch2][C][C][=C][C][=C][C][=C][Ring1][=Branch1][N][C][Ring2][=Branch1][=N][=O] | IUAYMJGZBVDSGL-XNNAEKOYSA-N | (3R,6S,9S,12S,15S,21R,24S,27S,30S,33S)-9,27-bis(3-aminopropyl)-3,21-dibenzyl-6,24-bis(2-methylpropyl)-12,30-di(propan-2-yl)-1,4,7,10,13,19,22,25,28,31-decazatricyclo[31.3.0.015,19]hexatriacontane-2,5,8,11,14,20,23,26,29,32-decone | Task: Please answer the multiple choice question.
Question: Is the molecule with the {SMILES__description} {#representation of |!}{SMILES#} {toxicity_SR-MMP__names__adjective}?
Constraint: Even if you are {#uncertain|not sure!}, you must pick either {%multiple_choice_enum%2%aA1} without using any {#other|additional!} words.
Options:
{toxicity_SR-MMP%}
Answer: {%multiple_choice_result} | Task: Please answer the multiple choice question.
Question: Is the molecule with the SMILES CC(C)C[C@@H]1NC(=O)[C@H](CCCN)NC(=O)[C@H](C(C)C)NC(=O)[C@@H]2CCCN2C(=O)[C@@H](Cc2ccccc2)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CCCN)NC(=O)[C@H](C(C)C)NC(=O)[C@@H]2CCCN2C(=O)[C@@H](Cc2ccccc2)NC1=O toxic in the SR-MMP assay?
Constraint: Even if you are uncertain, you must pick either a or b without using any other words.
Options:
[a] False
[b] True
Answer: b |
|
TOX5816 | O=C(O)C(=O)O | 0 | train | O=C(O)C(=O)O | [O][=C][Branch1][C][O][C][=Branch1][C][=O][O] | MUBZPKHOEPUJKR-UHFFFAOYSA-N | oxalicacid | Task: Please answer the multiple choice question.
Question: Is the molecule with the {SMILES__description} {#representation of |!}{SMILES#} {toxicity_SR-MMP__names__adjective}?
Constraint: Even if you are {#uncertain|not sure!}, you must pick either {%multiple_choice_enum%2%aA1} without using any {#other|additional!} words.
Options:
{toxicity_SR-MMP%}
Answer: {%multiple_choice_result} | Task: Please answer the multiple choice question.
Question: Is the molecule with the SMILES O=C(O)C(=O)O toxic in the SR-Mitochondrial membrane potential assay?
Constraint: Even if you are not sure, you must pick either a or b without using any other words.
Options:
[a] False
[b] True
Answer: a |
|
TOX20674 | CC1(C)O[C@@H]2C[C@H]3[C@@H]4C[C@H](F)C5=CC(=O)C=C[C@]5(C)[C@@]4(F)[C@@H](O)C[C@]3(C)[C@]2(C(=O)CO)O1 | 0 | train | CC1(C)O[C@@H]2C[C@H]3[C@@H]4C[C@H](F)C5=CC(=O)C=C[C@]5(C)[C@@]4(F)[C@@H](O)C[C@]3(C)[C@]2(C(=O)CO)O1 | [C][C][Branch1][C][C][O][C@@H1][C][C@H1][C@@H1][C][C@H1][Branch1][C][F][C][=C][C][=Branch1][C][=O][C][=C][C@][Ring1][#Branch1][Branch1][C][C][C@@][Ring1][=N][Branch1][C][F][C@@H1][Branch1][C][O][C][C@][Ring2][Ring1][Ring1][Branch1][C][C][C@][Ring2][Ring1][#Branch1][Branch1][#Branch1][C][=Branch1][C][=O][C][O][O][Ring2][Ring1][#C] | FEBLZLNTKCEFIT-VSXGLTOVSA-N | (1S,2S,4R,8S,9S,11S,12R,13S,19S)-12,19-difluoro-11-hydroxy-8-(2-hydroxyacetyl)-6,6,9,13-tetramethyl-5,7-dioxapentacyclo[10.8.0.02,9.04,8.013,18]icosa-14,17-dien-16-one | Task: Please answer the multiple choice question.
Question: Is the molecule with the {SMILES__description} {#representation of |!}{SMILES#} {toxicity_SR-MMP__names__adjective}?
Constraint: Even if you are {#uncertain|not sure!}, you must pick either {%multiple_choice_enum%2%aA1} without using any {#other|additional!} words.
Options:
{toxicity_SR-MMP%}
Answer: {%multiple_choice_result} | Task: Please answer the multiple choice question.
Question: Is the molecule with the SMILES representation of CC1(C)O[C@@H]2C[C@H]3[C@@H]4C[C@H](F)C5=CC(=O)C=C[C@]5(C)[C@@]4(F)[C@@H](O)C[C@]3(C)[C@]2(C(=O)CO)O1 toxic in the SR-MMP assay?
Constraint: Even if you are not sure, you must pick either a or b without using any additional words.
Options:
a. False
b. True
Answer: a |
|
TOX983 | O=[N+]([O-])c1ccc2ccc3cccc4ccc1c2c34 | 1 | train | O=[N+]([O-])c1ccc2ccc3cccc4ccc1c2c34 | [O][=N+1][Branch1][C][O-1][C][=C][C][=C][C][=C][C][=C][C][=C][C][=C][C][=C][Ring1][=C][C][Ring1][N][=C][Ring1][#Branch2][Ring1][=Branch1] | ALRLPDGCPYIVHP-UHFFFAOYSA-N | 1-nitropyrene | Task: Please answer the multiple choice question.
Question: Is the molecule with the {SMILES__description} {#representation of |!}{SMILES#} {toxicity_SR-MMP__names__adjective}?
Constraint: Even if you are {#uncertain|not sure!}, you must pick either {%multiple_choice_enum%2%aA1} without using any {#other|additional!} words.
Options:
{toxicity_SR-MMP%}
Answer: {%multiple_choice_result} | Task: Please answer the multiple choice question.
Question: Is the molecule with the SMILES O=[N+]([O-])c1ccc2ccc3cccc4ccc1c2c34 toxic in the SR-MMP assay?
Constraint: Even if you are uncertain, you must pick either a or b without using any other words.
Options:
[a] True
[b] False
Answer: a |
|
TOX1380 | ClCC(Cl)Cl | 0 | train | ClCC(Cl)Cl | [Cl][C][C][Branch1][C][Cl][Cl] | UBOXGVDOUJQMTN-UHFFFAOYSA-N | 1,1,2-trichloroethane | Task: Please answer the multiple choice question.
Question: Is the molecule with the {SMILES__description} {#representation of |!}{SMILES#} {toxicity_SR-MMP__names__adjective}?
Constraint: Even if you are {#uncertain|not sure!}, you must pick either {%multiple_choice_enum%2%aA1} without using any {#other|additional!} words.
Options:
{toxicity_SR-MMP%}
Answer: {%multiple_choice_result} | Task: Please answer the multiple choice question.
Question: Is the molecule with the SMILES representation of ClCC(Cl)Cl toxic in the SR-MMP assay?
Constraint: Even if you are not sure, you must pick either a or b without using any other words.
Options:
(a) True
(b) False
Answer: b |
|
TOX1219 | O=c1c(O)c(-c2ccc(O)c(O)c2)oc2cc(O)cc(O)c12 | 1 | train | O=c1c(O)c(-c2ccc(O)c(O)c2)oc2cc(O)cc(O)c12 | [O][=C][C][Branch1][C][O][=C][Branch1][#C][C][=C][C][=C][Branch1][C][O][C][Branch1][C][O][=C][Ring1][Branch2][O][C][=C][C][Branch1][C][O][=C][C][Branch1][C][O][=C][Ring2][Ring1][Branch1][Ring1][Branch2] | REFJWTPEDVJJIY-UHFFFAOYSA-N | 2-(3,4-dihydroxyphenyl)-3,5,7-trihydroxychromen-4-one | Task: Please answer the multiple choice question.
Question: Is the molecule with the {SMILES__description} {#representation of |!}{SMILES#} {toxicity_SR-MMP__names__adjective}?
Constraint: Even if you are {#uncertain|not sure!}, you must pick either {%multiple_choice_enum%2%aA1} without using any {#other|additional!} words.
Options:
{toxicity_SR-MMP%}
Answer: {%multiple_choice_result} | Task: Please answer the multiple choice question.
Question: Is the molecule with the SMILES O=c1c(O)c(-c2ccc(O)c(O)c2)oc2cc(O)cc(O)c12 toxic in the SR-Mitochondrial membrane potential assay?
Constraint: Even if you are not sure, you must pick either a or b without using any other words.
Options:
a: False
b: True
Answer: b |
|
TOX694 | CN(C)P(=O)(N(C)C)N(C)C | 0 | train | CN(C)P(=O)(N(C)C)N(C)C | [C][N][Branch1][C][C][P][=Branch1][C][=O][Branch1][=Branch1][N][Branch1][C][C][C][N][Branch1][C][C][C] | GNOIPBMMFNIUFM-UHFFFAOYSA-N | N-[bis(dimethylamino)phosphoryl]-N-methylmethanamine | Task: Please answer the multiple choice question.
Question: Is the molecule with the {SMILES__description} {#representation of |!}{SMILES#} {toxicity_SR-MMP__names__adjective}?
Constraint: Even if you are {#uncertain|not sure!}, you must pick either {%multiple_choice_enum%2%aA1} without using any {#other|additional!} words.
Options:
{toxicity_SR-MMP%}
Answer: {%multiple_choice_result} | Task: Please answer the multiple choice question.
Question: Is the molecule with the SMILES CN(C)P(=O)(N(C)C)N(C)C toxic in the SR-MMP assay?
Constraint: Even if you are not sure, you must pick either a or b without using any additional words.
Options:
a False
b True
Answer: a |
|
TOX9607 | C=C(C)C(=O)OCCOCCOCCOC(=O)C(=C)C | 0 | train | C=C(C)C(=O)OCCOCCOCCOC(=O)C(=C)C | [C][=C][Branch1][C][C][C][=Branch1][C][=O][O][C][C][O][C][C][O][C][C][O][C][=Branch1][C][=O][C][=Branch1][C][=C][C] | HWSSEYVMGDIFMH-UHFFFAOYSA-N | 2-[2-[2-(2-methylprop-2-enoyloxy)ethoxy]ethoxy]ethyl2-methylprop-2-enoate | Task: Please answer the multiple choice question.
Question: Is the molecule with the {SMILES__description} {#representation of |!}{SMILES#} {toxicity_SR-MMP__names__adjective}?
Constraint: Even if you are {#uncertain|not sure!}, you must pick either {%multiple_choice_enum%2%aA1} without using any {#other|additional!} words.
Options:
{toxicity_SR-MMP%}
Answer: {%multiple_choice_result} | Task: Please answer the multiple choice question.
Question: Is the molecule with the SMILES representation of C=C(C)C(=O)OCCOCCOCCOC(=O)C(=C)C toxic in the Mitochondrial membrane potential assay?
Constraint: Even if you are uncertain, you must pick either a or b without using any other words.
Options:
[a] False
[b] True
Answer: a |
|
TOX6224 | COCCOCCOCCOC | 0 | train | COCCOCCOCCOC | [C][O][C][C][O][C][C][O][C][C][O][C] | YFNKIDBQEZZDLK-UHFFFAOYSA-N | 1-methoxy-2-[2-(2-methoxyethoxy)ethoxy]ethane | Task: Please answer the multiple choice question.
Question: Is the molecule with the {SMILES__description} {#representation of |!}{SMILES#} {toxicity_SR-MMP__names__adjective}?
Constraint: Even if you are {#uncertain|not sure!}, you must pick either {%multiple_choice_enum%2%aA1} without using any {#other|additional!} words.
Options:
{toxicity_SR-MMP%}
Answer: {%multiple_choice_result} | Task: Please answer the multiple choice question.
Question: Is the molecule with the SMILES representation of COCCOCCOCCOC toxic in the SR-Mitochondrial membrane potential assay?
Constraint: Even if you are uncertain, you must pick either a or b without using any other words.
Options:
(a) False
(b) True
Answer: a |
|
TOX5371 | FC(F)(F)C(Cl)Br | 0 | train | FC(F)(F)C(Cl)Br | [F][C][Branch1][C][F][Branch1][C][F][C][Branch1][C][Cl][Br] | BCQZXOMGPXTTIC-UHFFFAOYSA-N | 1-bromo-1-chloro-2,2,2-trifluoroethane | Task: Please answer the multiple choice question.
Question: Is the molecule with the {SMILES__description} {#representation of |!}{SMILES#} {toxicity_SR-MMP__names__adjective}?
Constraint: Even if you are {#uncertain|not sure!}, you must pick either {%multiple_choice_enum%2%aA1} without using any {#other|additional!} words.
Options:
{toxicity_SR-MMP%}
Answer: {%multiple_choice_result} | Task: Please answer the multiple choice question.
Question: Is the molecule with the SMILES FC(F)(F)C(Cl)Br toxic in the SR-MMP assay?
Constraint: Even if you are not sure, you must pick either a or b without using any other words.
Options:
(a) False
(b) True
Answer: a |
|
TOX21357 | CCCCC/C=C\C=C\C(=O)OCC | 1 | train | CCCCC/C=C\C=C\C(=O)OCC | [C][C][C][C][C][/C][=C][\C][=C][\C][=Branch1][C][=O][O][C][C] | OPCRGEVPIBLWAY-QNRZBPGKSA-N | ethyl(2E,4Z)-deca-2,4-dienoate | Task: Please answer the multiple choice question.
Question: Is the molecule with the {SMILES__description} {#representation of |!}{SMILES#} {toxicity_SR-MMP__names__adjective}?
Constraint: Even if you are {#uncertain|not sure!}, you must pick either {%multiple_choice_enum%2%aA1} without using any {#other|additional!} words.
Options:
{toxicity_SR-MMP%}
Answer: {%multiple_choice_result} | Task: Please answer the multiple choice question.
Question: Is the molecule with the SMILES CCCCC/C=C\C=C\C(=O)OCC toxic in the Mitochondrial membrane potential assay?
Constraint: Even if you are not sure, you must pick either a or b without using any other words.
Options:
a. True
b. False
Answer: a |
|
TOX27585 | CC/C=C\CCOC(=O)C(C)C | 0 | train | CC/C=C\CCOC(=O)C(C)C | [C][C][/C][=C][\C][C][O][C][=Branch1][C][=O][C][Branch1][C][C][C] | OSMAJVWUIUORGC-WAYWQWQTSA-N | [(Z)-hex-3-enyl] 2-methylpropanoate | Task: Please answer the multiple choice question.
Question: Is the molecule with the {SMILES__description} {#representation of |!}{SMILES#} {toxicity_SR-MMP__names__adjective}?
Constraint: Even if you are {#uncertain|not sure!}, you must pick either {%multiple_choice_enum%2%aA1} without using any {#other|additional!} words.
Options:
{toxicity_SR-MMP%}
Answer: {%multiple_choice_result} | Task: Please answer the multiple choice question.
Question: Is the molecule with the SMILES representation of CC/C=C\CCOC(=O)C(C)C toxic in the SR-MMP assay?
Constraint: Even if you are uncertain, you must pick either a or b without using any other words.
Options:
a.) True
b.) False
Answer: b |
|
TOX9145 | COC(=O)CC(=O)OC | 0 | train | COC(=O)CC(=O)OC | [C][O][C][=Branch1][C][=O][C][C][=Branch1][C][=O][O][C] | BEPAFCGSDWSTEL-UHFFFAOYSA-N | dimethyl propanedioate | Task: Please answer the multiple choice question.
Question: Is the molecule with the {SMILES__description} {#representation of |!}{SMILES#} {toxicity_SR-MMP__names__adjective}?
Constraint: Even if you are {#uncertain|not sure!}, you must pick either {%multiple_choice_enum%2%aA1} without using any {#other|additional!} words.
Options:
{toxicity_SR-MMP%}
Answer: {%multiple_choice_result} | Task: Please answer the multiple choice question.
Question: Is the molecule with the SMILES representation of COC(=O)CC(=O)OC toxic in the Mitochondrial membrane potential assay?
Constraint: Even if you are uncertain, you must pick either a or b without using any additional words.
Options:
(a) False
(b) True
Answer: a |
|
TOX25879 | CC(=O)NCCCCCC(=O)O | 0 | train | CC(=O)NCCCCCC(=O)O | [C][C][=Branch1][C][=O][N][C][C][C][C][C][C][=Branch1][C][=O][O] | WDSCBUNMANHPFH-UHFFFAOYSA-N | 6-acetamidohexanoic acid | Task: Please answer the multiple choice question.
Question: Is the molecule with the {SMILES__description} {#representation of |!}{SMILES#} {toxicity_SR-MMP__names__adjective}?
Constraint: Even if you are {#uncertain|not sure!}, you must pick either {%multiple_choice_enum%2%aA1} without using any {#other|additional!} words.
Options:
{toxicity_SR-MMP%}
Answer: {%multiple_choice_result} | Task: Please answer the multiple choice question.
Question: Is the molecule with the SMILES representation of CC(=O)NCCCCCC(=O)O toxic in the Mitochondrial membrane potential assay?
Constraint: Even if you are not sure, you must pick either a or b without using any other words.
Options:
a False
b True
Answer: a |
|
TOX28423 | c1ccc2cc(CC3=NCCN3)ccc2c1 | 0 | train | c1ccc2cc(CC3=NCCN3)ccc2c1 | [C][=C][C][=C][C][=C][Branch1][=Branch2][C][C][=N][C][C][N][Ring1][Branch1][C][=C][C][Ring1][N][=C][Ring1][S] | VIXRKFBKWOHVBR-UHFFFAOYSA-N | 2-(naphthalen-6-ylmethyl)-4,5-dihydroimidazole | Task: Please answer the multiple choice question.
Question: Is the molecule with the {SMILES__description} {#representation of |!}{SMILES#} {toxicity_SR-MMP__names__adjective}?
Constraint: Even if you are {#uncertain|not sure!}, you must pick either {%multiple_choice_enum%2%aA1} without using any {#other|additional!} words.
Options:
{toxicity_SR-MMP%}
Answer: {%multiple_choice_result} | Task: Please answer the multiple choice question.
Question: Is the molecule with the SMILES c1ccc2cc(CC3=NCCN3)ccc2c1 toxic in the SR-MMP assay?
Constraint: Even if you are uncertain, you must pick either a or b without using any other words.
Options:
[a] False
[b] True
Answer: a |
|
TOX4409 | CC(=O)c1ccccn1 | 0 | train | CC(=O)c1ccccn1 | [C][C][=Branch1][C][=O][C][=C][C][=C][C][=N][Ring1][=Branch1] | AJKVQEKCUACUMD-UHFFFAOYSA-N | 1-pyridin-2-ylethanone | Task: Please answer the multiple choice question.
Question: Is the molecule with the {SMILES__description} {#representation of |!}{SMILES#} {toxicity_SR-MMP__names__adjective}?
Constraint: Even if you are {#uncertain|not sure!}, you must pick either {%multiple_choice_enum%2%aA1} without using any {#other|additional!} words.
Options:
{toxicity_SR-MMP%}
Answer: {%multiple_choice_result} | Task: Please answer the multiple choice question.
Question: Is the molecule with the SMILES representation of CC(=O)c1ccccn1 toxic in the SR-MMP assay?
Constraint: Even if you are not sure, you must pick either a or b without using any other words.
Options:
a.) True
b.) False
Answer: b |
|
TOX6863 | CC(O)COCC(C)O | 0 | train | CC(O)COCC(C)O | [C][C][Branch1][C][O][C][O][C][C][Branch1][C][C][O] | AZUXKVXMJOIAOF-UHFFFAOYSA-N | 1-(2-hydroxypropoxy)propan-2-ol | Task: Please answer the multiple choice question.
Question: Is the molecule with the {SMILES__description} {#representation of |!}{SMILES#} {toxicity_SR-MMP__names__adjective}?
Constraint: Even if you are {#uncertain|not sure!}, you must pick either {%multiple_choice_enum%2%aA1} without using any {#other|additional!} words.
Options:
{toxicity_SR-MMP%}
Answer: {%multiple_choice_result} | Task: Please answer the multiple choice question.
Question: Is the molecule with the SMILES CC(O)COCC(C)O toxic in the Mitochondrial membrane potential assay?
Constraint: Even if you are not sure, you must pick either a or b without using any other words.
Options:
a False
b True
Answer: a |
|
TOX27281 | CC(C)(O)c1ccc(CNC(=O)c2cccnc2Oc2ccc3nonc3c2)cc1 | 0 | train | CC(C)(O)c1ccc(CNC(=O)c2cccnc2Oc2ccc3nonc3c2)cc1 | [C][C][Branch1][C][C][Branch1][C][O][C][=C][C][=C][Branch2][Ring1][=N][C][N][C][=Branch1][C][=O][C][=C][C][=C][N][=C][Ring1][=Branch1][O][C][C][=C][C][=N][O][N][=C][Ring1][Branch1][C][=Ring1][=Branch2][C][=C][Ring2][Ring1][#Branch2] | QYZRHDNGOVTVDB-UHFFFAOYSA-N | 2-(2,1,3-benzoxadiazol-5-yloxy)-N-[[4-(2-hydroxypropan-2-yl)phenyl]methyl]pyridine-3-carboxamide | Task: Please answer the multiple choice question.
Question: Is the molecule with the {SMILES__description} {#representation of |!}{SMILES#} {toxicity_SR-MMP__names__adjective}?
Constraint: Even if you are {#uncertain|not sure!}, you must pick either {%multiple_choice_enum%2%aA1} without using any {#other|additional!} words.
Options:
{toxicity_SR-MMP%}
Answer: {%multiple_choice_result} | Task: Please answer the multiple choice question.
Question: Is the molecule with the SMILES CC(C)(O)c1ccc(CNC(=O)c2cccnc2Oc2ccc3nonc3c2)cc1 toxic in the Mitochondrial membrane potential assay?
Constraint: Even if you are uncertain, you must pick either a or b without using any other words.
Options:
a False
b True
Answer: a |
|
TOX25153 | Cc1nc2c([nH]1)c(=O)n(C)c(=O)n2Cc1ccco1 | 0 | train | Cc1nc2c([nH]1)c(=O)n(C)c(=O)n2Cc1ccco1 | [C][C][=N][C][=C][Branch1][Ring2][NH1][Ring1][Branch1][C][=Branch1][C][=O][N][Branch1][C][C][C][=Branch1][C][=O][N][Ring1][#Branch2][C][C][=C][C][=C][O][Ring1][Branch1] | KGQZGCIVHYLPBH-UHFFFAOYSA-N | 3-(furan-2-ylmethyl)-1,8-dimethyl-7H-purine-2,6-dione | Task: Please answer the multiple choice question.
Question: Is the molecule with the {SMILES__description} {#representation of |!}{SMILES#} {toxicity_SR-MMP__names__adjective}?
Constraint: Even if you are {#uncertain|not sure!}, you must pick either {%multiple_choice_enum%2%aA1} without using any {#other|additional!} words.
Options:
{toxicity_SR-MMP%}
Answer: {%multiple_choice_result} | Task: Please answer the multiple choice question.
Question: Is the molecule with the SMILES representation of Cc1nc2c([nH]1)c(=O)n(C)c(=O)n2Cc1ccco1 toxic in the SR-Mitochondrial membrane potential assay?
Constraint: Even if you are uncertain, you must pick either a or b without using any additional words.
Options:
[a] False
[b] True
Answer: a |
|
TOX2993 | CCOC(=O)CCC(=O)O[C@H]1[C@H](O[C@@H]2[C@@H](C)[C@H](O[C@H]3C[C@@](C)(OC)[C@@H](O)[C@H](C)O3)[C@@H](C)C(=O)O[C@H](CC)[C@@](C)(O)[C@H](O)[C@@H](C)C(=O)[C@H](C)C[C@@]2(C)O)O[C@H](C)C[C@@H]1N(C)C | 0 | train | CCOC(=O)CCC(=O)O[C@H]1[C@H](O[C@@H]2[C@@H](C)[C@H](O[C@H]3C[C@@](C)(OC)[C@@H](O)[C@H](C)O3)[C@@H](C)C(=O)O[C@H](CC)[C@@](C)(O)[C@H](O)[C@@H](C)C(=O)[C@H](C)C[C@@]2(C)O)O[C@H](C)C[C@@H]1N(C)C | [C][C][O][C][=Branch1][C][=O][C][C][C][=Branch1][C][=O][O][C@H1][C@H1][Branch2][=Branch1][#C][O][C@@H1][C@@H1][Branch1][C][C][C@H1][Branch2][Ring1][#Branch1][O][C@H1][C][C@@][Branch1][C][C][Branch1][Ring1][O][C][C@@H1][Branch1][C][O][C@H1][Branch1][C][C][O][Ring1][O][C@@H1][Branch1][C][C][C][=Branch1][C][=O][O][C@H1][Branch1][Ring1][C][C][C@@][Branch1][C][C][Branch1][C][O][C@H1][Branch1][C][O][C@@H1][Branch1][C][C][C][=Branch1][C][=O][C@H1][Branch1][C][C][C][C@@][Ring2][Ring2][Branch1][Branch1][C][C][O][O][C@H1][Branch1][C][C][C][C@@H1][Ring2][Ring2][#C][N][Branch1][C][C][C] | NSYZCCDSJNWWJL-YXOIYICCSA-N | 4-O-[(2S,3R,4S,6R)-4-(dimethylamino)-2-[[(3R,4S,5S,6R,7R,9R,11R,12R,13S,14R)-14-ethyl-7,12,13-trihydroxy-4-[(2R,4R,5S,6S)-5-hydroxy-4-methoxy-4,6-dimethyloxan-2-yl]oxy-3,5,7,9,11,13-hexamethyl-2,10-dioxo-oxacyclotetradec-6-yl]oxy]-6-methyloxan-3-yl] 1-O-ethyl butanedioate | Task: Please answer the multiple choice question.
Question: Is the molecule with the {SMILES__description} {#representation of |!}{SMILES#} {toxicity_SR-MMP__names__adjective}?
Constraint: Even if you are {#uncertain|not sure!}, you must pick either {%multiple_choice_enum%2%aA1} without using any {#other|additional!} words.
Options:
{toxicity_SR-MMP%}
Answer: {%multiple_choice_result} | Task: Please answer the multiple choice question.
Question: Is the molecule with the SMILES CCOC(=O)CCC(=O)O[C@H]1[C@H](O[C@@H]2[C@@H](C)[C@H](O[C@H]3C[C@@](C)(OC)[C@@H](O)[C@H](C)O3)[C@@H](C)C(=O)O[C@H](CC)[C@@](C)(O)[C@H](O)[C@@H](C)C(=O)[C@H](C)C[C@@]2(C)O)O[C@H](C)C[C@@H]1N(C)C toxic in the SR-MMP assay?
Constraint: Even if you are uncertain, you must pick either a or b without using any other words.
Options:
a: True
b: False
Answer: b |
|
TOX4573 | c1ccc2[nH]cnc2c1 | 0 | train | c1ccc2[nH]cnc2c1 | [C][=C][C][=C][NH1][C][=N][C][Ring1][Branch1][=C][Ring1][=Branch2] | HYZJCKYKOHLVJF-UHFFFAOYSA-N | 1H-benzimidazole | Task: Please answer the multiple choice question.
Question: Is the molecule with the {SMILES__description} {#representation of |!}{SMILES#} {toxicity_SR-MMP__names__adjective}?
Constraint: Even if you are {#uncertain|not sure!}, you must pick either {%multiple_choice_enum%2%aA1} without using any {#other|additional!} words.
Options:
{toxicity_SR-MMP%}
Answer: {%multiple_choice_result} | Task: Please answer the multiple choice question.
Question: Is the molecule with the SMILES c1ccc2[nH]cnc2c1 toxic in the SR-Mitochondrial membrane potential assay?
Constraint: Even if you are uncertain, you must pick either a or b without using any additional words.
Options:
a.) False
b.) True
Answer: a |
|
TOX27609 | CCCCC1CCC(=O)O1 | 0 | train | CCCCC1CCC(=O)O1 | [C][C][C][C][C][C][C][C][=Branch1][C][=O][O][Ring1][=Branch1] | IPBFYZQJXZJBFQ-UHFFFAOYSA-N | 5-butyloxolan-2-one | Task: Please answer the multiple choice question.
Question: Is the molecule with the {SMILES__description} {#representation of |!}{SMILES#} {toxicity_SR-MMP__names__adjective}?
Constraint: Even if you are {#uncertain|not sure!}, you must pick either {%multiple_choice_enum%2%aA1} without using any {#other|additional!} words.
Options:
{toxicity_SR-MMP%}
Answer: {%multiple_choice_result} | Task: Please answer the multiple choice question.
Question: Is the molecule with the SMILES CCCCC1CCC(=O)O1 toxic in the SR-MMP assay?
Constraint: Even if you are uncertain, you must pick either a or b without using any other words.
Options:
(a) False
(b) True
Answer: a |
|
TOX15491 | CCCCCCCC[N+](C)(C)CCCCCCCC | 1 | train | CCCCCCCC[N+](C)(C)CCCCCCCC | [C][C][C][C][C][C][C][C][N+1][Branch1][C][C][Branch1][C][C][C][C][C][C][C][C][C][C] | MELGLHXCBHKVJG-UHFFFAOYSA-N | dimethyl(dioctyl)azanium | Task: Please answer the multiple choice question.
Question: Is the molecule with the {SMILES__description} {#representation of |!}{SMILES#} {toxicity_SR-MMP__names__adjective}?
Constraint: Even if you are {#uncertain|not sure!}, you must pick either {%multiple_choice_enum%2%aA1} without using any {#other|additional!} words.
Options:
{toxicity_SR-MMP%}
Answer: {%multiple_choice_result} | Task: Please answer the multiple choice question.
Question: Is the molecule with the SMILES CCCCCCCC[N+](C)(C)CCCCCCCC toxic in the SR-MMP assay?
Constraint: Even if you are not sure, you must pick either a or b without using any other words.
Options:
[a] False
[b] True
Answer: b |
|
TOX2524 | O=C1CCC(N2C(=O)c3ccccc3C2=O)C(=O)N1 | 0 | train | O=C1CCC(N2C(=O)c3ccccc3C2=O)C(=O)N1 | [O][=C][C][C][C][Branch2][Ring1][C][N][C][=Branch1][C][=O][C][=C][C][=C][C][=C][Ring1][=Branch1][C][Ring1][#Branch2][=O][C][=Branch1][C][=O][N][Ring2][Ring1][C] | UEJJHQNACJXSKW-UHFFFAOYSA-N | 2-(2,6-dioxopiperidin-3-yl)isoindole-1,3-dione | Task: Please answer the multiple choice question.
Question: Is the molecule with the {SMILES__description} {#representation of |!}{SMILES#} {toxicity_SR-MMP__names__adjective}?
Constraint: Even if you are {#uncertain|not sure!}, you must pick either {%multiple_choice_enum%2%aA1} without using any {#other|additional!} words.
Options:
{toxicity_SR-MMP%}
Answer: {%multiple_choice_result} | Task: Please answer the multiple choice question.
Question: Is the molecule with the SMILES O=C1CCC(N2C(=O)c3ccccc3C2=O)C(=O)N1 toxic in the Mitochondrial membrane potential assay?
Constraint: Even if you are uncertain, you must pick either a or b without using any other words.
Options:
(a) True
(b) False
Answer: b |
|
TOX7328 | O=S(=O)([O-])CO | 0 | train | O=S(=O)([O-])CO | [O][=S][=Branch1][C][=O][Branch1][C][O-1][C][O] | DETXZQGDWUJKMO-UHFFFAOYSA-M | hydroxymethanesulfonate | Task: Please answer the multiple choice question.
Question: Is the molecule with the {SMILES__description} {#representation of |!}{SMILES#} {toxicity_SR-MMP__names__adjective}?
Constraint: Even if you are {#uncertain|not sure!}, you must pick either {%multiple_choice_enum%2%aA1} without using any {#other|additional!} words.
Options:
{toxicity_SR-MMP%}
Answer: {%multiple_choice_result} | Task: Please answer the multiple choice question.
Question: Is the molecule with the SMILES representation of O=S(=O)([O-])CO toxic in the SR-Mitochondrial membrane potential assay?
Constraint: Even if you are uncertain, you must pick either a or b without using any other words.
Options:
a. False
b. True
Answer: a |
|
TOX6122 | CN(C)CCN(C)C | 0 | train | CN(C)CCN(C)C | [C][N][Branch1][C][C][C][C][N][Branch1][C][C][C] | KWYHDKDOAIKMQN-UHFFFAOYSA-N | N,N,N',N'-tetramethylethane-1,2-diamine | Task: Please answer the multiple choice question.
Question: Is the molecule with the {SMILES__description} {#representation of |!}{SMILES#} {toxicity_SR-MMP__names__adjective}?
Constraint: Even if you are {#uncertain|not sure!}, you must pick either {%multiple_choice_enum%2%aA1} without using any {#other|additional!} words.
Options:
{toxicity_SR-MMP%}
Answer: {%multiple_choice_result} | Task: Please answer the multiple choice question.
Question: Is the molecule with the SMILES CN(C)CCN(C)C toxic in the SR-MMP assay?
Constraint: Even if you are uncertain, you must pick either a or b without using any additional words.
Options:
(a) False
(b) True
Answer: a |
|
TOX4448 | C=CCSSCCC | 0 | train | C=CCSSCCC | [C][=C][C][S][S][C][C][C] | FCSSPCOFDUKHPV-UHFFFAOYSA-N | 1-(prop-2-enyldisulfanyl)propane | Task: Please answer the multiple choice question.
Question: Is the molecule with the {SMILES__description} {#representation of |!}{SMILES#} {toxicity_SR-MMP__names__adjective}?
Constraint: Even if you are {#uncertain|not sure!}, you must pick either {%multiple_choice_enum%2%aA1} without using any {#other|additional!} words.
Options:
{toxicity_SR-MMP%}
Answer: {%multiple_choice_result} | Task: Please answer the multiple choice question.
Question: Is the molecule with the SMILES representation of C=CCSSCCC toxic in the SR-MMP assay?
Constraint: Even if you are uncertain, you must pick either a or b without using any additional words.
Options:
a) False
b) True
Answer: a |
|
TOX26097 | CC1(C)S[C@@H]2[C@H](N)C(=O)N2[C@H]1C(=O)O | 0 | train | CC1(C)S[C@@H]2[C@H](N)C(=O)N2[C@H]1C(=O)O | [C][C][Branch1][C][C][S][C@@H1][C@H1][Branch1][C][N][C][=Branch1][C][=O][N][Ring1][=Branch1][C@H1][Ring1][#Branch2][C][=Branch1][C][=O][O] | NGHVIOIJCVXTGV-ALEPSDHESA-N | (2S,5R,6R)-6-amino-3,3-dimethyl-7-oxo-4-thia-1-azabicyclo[3.2.0]heptane-2-carboxylic acid | Task: Please answer the multiple choice question.
Question: Is the molecule with the {SMILES__description} {#representation of |!}{SMILES#} {toxicity_SR-MMP__names__adjective}?
Constraint: Even if you are {#uncertain|not sure!}, you must pick either {%multiple_choice_enum%2%aA1} without using any {#other|additional!} words.
Options:
{toxicity_SR-MMP%}
Answer: {%multiple_choice_result} | Task: Please answer the multiple choice question.
Question: Is the molecule with the SMILES representation of CC1(C)S[C@@H]2[C@H](N)C(=O)N2[C@H]1C(=O)O toxic in the SR-MMP assay?
Constraint: Even if you are uncertain, you must pick either a or b without using any additional words.
Options:
a: False
b: True
Answer: a |
|
TOX2636 | CN1CCC(=C2c3ccccc3CCc3cccnc32)CC1 | 0 | train | CN1CCC(=C2c3ccccc3CCc3cccnc32)CC1 | [C][N][C][C][C][=Branch2][Ring1][=Branch1][=C][C][=C][C][=C][C][=C][Ring1][=Branch1][C][C][C][=C][C][=C][N][=C][Ring1][=Branch1][Ring1][#C][C][C][Ring2][Ring1][Branch1] | SEBMTIQKRHYNIT-UHFFFAOYSA-N | 2-(1-methylpiperidin-4-ylidene)-4-azatricyclo[9.4.0.03,8]pentadeca-1(15),3(8),4,6,11,13-hexaene | Task: Please answer the multiple choice question.
Question: Is the molecule with the {SMILES__description} {#representation of |!}{SMILES#} {toxicity_SR-MMP__names__adjective}?
Constraint: Even if you are {#uncertain|not sure!}, you must pick either {%multiple_choice_enum%2%aA1} without using any {#other|additional!} words.
Options:
{toxicity_SR-MMP%}
Answer: {%multiple_choice_result} | Task: Please answer the multiple choice question.
Question: Is the molecule with the SMILES CN1CCC(=C2c3ccccc3CCc3cccnc32)CC1 toxic in the SR-Mitochondrial membrane potential assay?
Constraint: Even if you are not sure, you must pick either a or b without using any additional words.
Options:
a.) False
b.) True
Answer: a |
|
TOX29296 | CCCCCCCCCCCCCCCBr | 0 | train | CCCCCCCCCCCCCCCBr | [C][C][C][C][C][C][C][C][C][C][C][C][C][C][C][Br] | JKOTZBXSNOGCIF-UHFFFAOYSA-N | 1-bromopentadecane | Task: Please answer the multiple choice question.
Question: Is the molecule with the {SMILES__description} {#representation of |!}{SMILES#} {toxicity_SR-MMP__names__adjective}?
Constraint: Even if you are {#uncertain|not sure!}, you must pick either {%multiple_choice_enum%2%aA1} without using any {#other|additional!} words.
Options:
{toxicity_SR-MMP%}
Answer: {%multiple_choice_result} | Task: Please answer the multiple choice question.
Question: Is the molecule with the SMILES representation of CCCCCCCCCCCCCCCBr toxic in the SR-MMP assay?
Constraint: Even if you are uncertain, you must pick either a or b without using any additional words.
Options:
a) False
b) True
Answer: a |
|
TOX1309 | CN1C(=O)C(O)N=C(c2ccccc2)c2cc(Cl)ccc21 | 0 | train | CN1C(=O)C(O)N=C(c2ccccc2)c2cc(Cl)ccc21 | [C][N][C][=Branch1][C][=O][C][Branch1][C][O][N][=C][Branch1][=Branch2][C][=C][C][=C][C][=C][Ring1][=Branch1][C][=C][C][Branch1][C][Cl][=C][C][=C][Ring1][#Branch1][Ring2][Ring1][Ring2] | SEQDDYPDSLOBDC-UHFFFAOYSA-N | 7-chloro-3-hydroxy-1-methyl-5-phenyl-3H-1,4-benzodiazepin-2-one | Task: Please answer the multiple choice question.
Question: Is the molecule with the {SMILES__description} {#representation of |!}{SMILES#} {toxicity_SR-MMP__names__adjective}?
Constraint: Even if you are {#uncertain|not sure!}, you must pick either {%multiple_choice_enum%2%aA1} without using any {#other|additional!} words.
Options:
{toxicity_SR-MMP%}
Answer: {%multiple_choice_result} | Task: Please answer the multiple choice question.
Question: Is the molecule with the SMILES CN1C(=O)C(O)N=C(c2ccccc2)c2cc(Cl)ccc21 toxic in the SR-MMP assay?
Constraint: Even if you are uncertain, you must pick either a or b without using any additional words.
Options:
a) False
b) True
Answer: a |
|
TOX3225 | O=C1Nc2ccc(Cl)cc2C(c2ccccc2Cl)=NC1O | 0 | train | O=C1Nc2ccc(Cl)cc2C(c2ccccc2Cl)=NC1O | [O][=C][N][C][=C][C][=C][Branch1][C][Cl][C][=C][Ring1][#Branch1][C][Branch1][#Branch2][C][=C][C][=C][C][=C][Ring1][=Branch1][Cl][=N][C][Ring2][Ring1][Ring1][O] | DIWRORZWFLOCLC-UHFFFAOYSA-N | 7-chloro-5-(6-chlorocyclohexa-1,3,5-trien-1-yl)-3-hydroxy-1,3-dihydro-1,4-benzodiazepin-2-one | Task: Please answer the multiple choice question.
Question: Is the molecule with the {SMILES__description} {#representation of |!}{SMILES#} {toxicity_SR-MMP__names__adjective}?
Constraint: Even if you are {#uncertain|not sure!}, you must pick either {%multiple_choice_enum%2%aA1} without using any {#other|additional!} words.
Options:
{toxicity_SR-MMP%}
Answer: {%multiple_choice_result} | Task: Please answer the multiple choice question.
Question: Is the molecule with the SMILES representation of O=C1Nc2ccc(Cl)cc2C(c2ccccc2Cl)=NC1O toxic in the Mitochondrial membrane potential assay?
Constraint: Even if you are not sure, you must pick either a or b without using any other words.
Options:
a True
b False
Answer: b |
|
TOX24493 | CCO[Si](CCCNC(N)=O)(OCC)OCC | 0 | train | CCO[Si](CCCNC(N)=O)(OCC)OCC | [C][C][O][Si][Branch1][#Branch2][C][C][C][N][C][Branch1][C][N][=O][Branch1][Ring2][O][C][C][O][C][C] | LVNLBBGBASVLLI-UHFFFAOYSA-N | 3-triethoxysilylpropylurea | Task: Please answer the multiple choice question.
Question: Is the molecule with the {SMILES__description} {#representation of |!}{SMILES#} {toxicity_SR-MMP__names__adjective}?
Constraint: Even if you are {#uncertain|not sure!}, you must pick either {%multiple_choice_enum%2%aA1} without using any {#other|additional!} words.
Options:
{toxicity_SR-MMP%}
Answer: {%multiple_choice_result} | Task: Please answer the multiple choice question.
Question: Is the molecule with the SMILES CCO[Si](CCCNC(N)=O)(OCC)OCC toxic in the Mitochondrial membrane potential assay?
Constraint: Even if you are uncertain, you must pick either a or b without using any other words.
Options:
a: True
b: False
Answer: b |
|
TOX7461 | NNC(=S)NN | 0 | train | NNC(=S)NN | [N][N][C][=Branch1][C][=S][N][N] | LJTFFORYSFGNCT-UHFFFAOYSA-N | 1,3-diaminothiourea | Task: Please answer the multiple choice question.
Question: Is the molecule with the {SMILES__description} {#representation of |!}{SMILES#} {toxicity_SR-MMP__names__adjective}?
Constraint: Even if you are {#uncertain|not sure!}, you must pick either {%multiple_choice_enum%2%aA1} without using any {#other|additional!} words.
Options:
{toxicity_SR-MMP%}
Answer: {%multiple_choice_result} | Task: Please answer the multiple choice question.
Question: Is the molecule with the SMILES representation of NNC(=S)NN toxic in the SR-MMP assay?
Constraint: Even if you are not sure, you must pick either a or b without using any additional words.
Options:
(a) True
(b) False
Answer: b |
|
TOX1653 | CCCCC=O | 0 | train | CCCCC=O | [C][C][C][C][C][=O] | HGBOYTHUEUWSSQ-UHFFFAOYSA-N | pentan-1-one | Task: Please answer the multiple choice question.
Question: Is the molecule with the {SMILES__description} {#representation of |!}{SMILES#} {toxicity_SR-MMP__names__adjective}?
Constraint: Even if you are {#uncertain|not sure!}, you must pick either {%multiple_choice_enum%2%aA1} without using any {#other|additional!} words.
Options:
{toxicity_SR-MMP%}
Answer: {%multiple_choice_result} | Task: Please answer the multiple choice question.
Question: Is the molecule with the SMILES CCCCC=O toxic in the SR-Mitochondrial membrane potential assay?
Constraint: Even if you are not sure, you must pick either a or b without using any additional words.
Options:
a.) False
b.) True
Answer: a |
|
TOX2131 | c1ccc(SSc2ccccc2)cc1 | 0 | train | c1ccc(SSc2ccccc2)cc1 | [C][=C][C][=C][Branch1][O][S][S][C][=C][C][=C][C][=C][Ring1][=Branch1][C][=C][Ring1][=C] | GUUVPOWQJOLRAS-UHFFFAOYSA-N | (phenyldisulfanyl)benzene | Task: Please answer the multiple choice question.
Question: Is the molecule with the {SMILES__description} {#representation of |!}{SMILES#} {toxicity_SR-MMP__names__adjective}?
Constraint: Even if you are {#uncertain|not sure!}, you must pick either {%multiple_choice_enum%2%aA1} without using any {#other|additional!} words.
Options:
{toxicity_SR-MMP%}
Answer: {%multiple_choice_result} | Task: Please answer the multiple choice question.
Question: Is the molecule with the SMILES representation of c1ccc(SSc2ccccc2)cc1 toxic in the Mitochondrial membrane potential assay?
Constraint: Even if you are not sure, you must pick either a or b without using any other words.
Options:
[a] True
[b] False
Answer: b |
|
TOX27587 | CC/C=C\CCCCCO | 0 | train | CC/C=C\CCCCCO | [C][C][/C][=C][\C][C][C][C][C][O] | XJHRZBIBSSVCEL-ARJAWSKDSA-N | (Z)-non-6-en-1-ol | Task: Please answer the multiple choice question.
Question: Is the molecule with the {SMILES__description} {#representation of |!}{SMILES#} {toxicity_SR-MMP__names__adjective}?
Constraint: Even if you are {#uncertain|not sure!}, you must pick either {%multiple_choice_enum%2%aA1} without using any {#other|additional!} words.
Options:
{toxicity_SR-MMP%}
Answer: {%multiple_choice_result} | Task: Please answer the multiple choice question.
Question: Is the molecule with the SMILES CC/C=C\CCCCCO toxic in the SR-Mitochondrial membrane potential assay?
Constraint: Even if you are not sure, you must pick either a or b without using any additional words.
Options:
a: False
b: True
Answer: a |
|
TOX4166 | O=C1C=CC(=O)O1 | 0 | train | O=C1C=CC(=O)O1 | [O][=C][C][=C][C][=Branch1][C][=O][O][Ring1][=Branch1] | FPYJFEHAWHCUMM-UHFFFAOYSA-N | furan-2,5-dione | Task: Please answer the multiple choice question.
Question: Is the molecule with the {SMILES__description} {#representation of |!}{SMILES#} {toxicity_SR-MMP__names__adjective}?
Constraint: Even if you are {#uncertain|not sure!}, you must pick either {%multiple_choice_enum%2%aA1} without using any {#other|additional!} words.
Options:
{toxicity_SR-MMP%}
Answer: {%multiple_choice_result} | Task: Please answer the multiple choice question.
Question: Is the molecule with the SMILES representation of O=C1C=CC(=O)O1 toxic in the Mitochondrial membrane potential assay?
Constraint: Even if you are not sure, you must pick either a or b without using any other words.
Options:
a.) False
b.) True
Answer: a |
|
TOX28677 | COc1cc2[nH]c(C)c(CCN3CCN(c4ccccc4)CC3)c2cc1OC | 0 | train | COc1cc2[nH]c(C)c(CCN3CCN(c4ccccc4)CC3)c2cc1OC | [C][O][C][=C][C][NH1][C][Branch1][C][C][=C][Branch2][Ring1][Branch1][C][C][N][C][C][N][Branch1][=Branch2][C][=C][C][=C][C][=C][Ring1][=Branch1][C][C][Ring1][N][C][=Ring2][Ring1][Ring2][C][=C][Ring2][Ring1][Branch2][O][C] | XCWPUUGSGHNIDZ-UHFFFAOYSA-N | 5,6-dimethoxy-2-methyl-3-[2-(4-phenylpiperazin-1-yl)ethyl]-1H-indole | Task: Please answer the multiple choice question.
Question: Is the molecule with the {SMILES__description} {#representation of |!}{SMILES#} {toxicity_SR-MMP__names__adjective}?
Constraint: Even if you are {#uncertain|not sure!}, you must pick either {%multiple_choice_enum%2%aA1} without using any {#other|additional!} words.
Options:
{toxicity_SR-MMP%}
Answer: {%multiple_choice_result} | Task: Please answer the multiple choice question.
Question: Is the molecule with the SMILES COc1cc2[nH]c(C)c(CCN3CCN(c4ccccc4)CC3)c2cc1OC toxic in the SR-MMP assay?
Constraint: Even if you are uncertain, you must pick either a or b without using any additional words.
Options:
(a) True
(b) False
Answer: b |
|
TOX28140 | COc1cc(C=O)cc2c1[C@H](COC(N)=O)[C@]1(OC(C)=O)ON2C[C@H]2[C@@H]1N2C(C)=O | 0 | train | COc1cc(C=O)cc2c1[C@H](COC(N)=O)[C@]1(OC(C)=O)ON2C[C@H]2[C@@H]1N2C(C)=O | [C][O][C][=C][C][Branch1][Ring1][C][=O][=C][C][=C][Ring1][Branch2][C@H1][Branch1][Branch2][C][O][C][Branch1][C][N][=O][C@][Branch1][#Branch1][O][C][Branch1][C][C][=O][O][N][Ring1][#C][C][C@H1][C@@H1][Ring1][#Branch2][N][Ring1][Ring1][C][Branch1][C][C][=O] | BUZDGGFWWPZBIN-MSIWLMLLSA-N | [(8R,9S,10S,12S)-11-acetyl-8-(carbamoyloxymethyl)-4-formyl-6-methoxy-14-oxa-1,11-diazatetracyclo[7.4.1.02,7.010,12]tetradeca-2(7),3,5-trien-9-yl] acetate | Task: Please answer the multiple choice question.
Question: Is the molecule with the {SMILES__description} {#representation of |!}{SMILES#} {toxicity_SR-MMP__names__adjective}?
Constraint: Even if you are {#uncertain|not sure!}, you must pick either {%multiple_choice_enum%2%aA1} without using any {#other|additional!} words.
Options:
{toxicity_SR-MMP%}
Answer: {%multiple_choice_result} | Task: Please answer the multiple choice question.
Question: Is the molecule with the SMILES representation of COc1cc(C=O)cc2c1[C@H](COC(N)=O)[C@]1(OC(C)=O)ON2C[C@H]2[C@@H]1N2C(C)=O toxic in the SR-MMP assay?
Constraint: Even if you are not sure, you must pick either a or b without using any additional words.
Options:
a) True
b) False
Answer: b |
|
TOX27103 | CCCCCCCCCCCCCCCCCCOS(=O)(=O)[O-] | 0 | train | CCCCCCCCCCCCCCCCCCOS(=O)(=O)[O-] | [C][C][C][C][C][C][C][C][C][C][C][C][C][C][C][C][C][C][O][S][=Branch1][C][=O][=Branch1][C][=O][O-1] | HVWGGPRWKSHASF-UHFFFAOYSA-M | octadecyl sulfate | Task: Please answer the multiple choice question.
Question: Is the molecule with the {SMILES__description} {#representation of |!}{SMILES#} {toxicity_SR-MMP__names__adjective}?
Constraint: Even if you are {#uncertain|not sure!}, you must pick either {%multiple_choice_enum%2%aA1} without using any {#other|additional!} words.
Options:
{toxicity_SR-MMP%}
Answer: {%multiple_choice_result} | Task: Please answer the multiple choice question.
Question: Is the molecule with the SMILES representation of CCCCCCCCCCCCCCCCCCOS(=O)(=O)[O-] toxic in the Mitochondrial membrane potential assay?
Constraint: Even if you are not sure, you must pick either a or b without using any other words.
Options:
a False
b True
Answer: a |
|
TOX9317 | C=CC(C)CCCC(C)(C)O | 0 | train | C=CC(C)CCCC(C)(C)O | [C][=C][C][Branch1][C][C][C][C][C][C][Branch1][C][C][Branch1][C][C][O] | XSNQECSCDATQEL-UHFFFAOYSA-N | 2,6-dimethylocta-7-en-2-ol | Task: Please answer the multiple choice question.
Question: Is the molecule with the {SMILES__description} {#representation of |!}{SMILES#} {toxicity_SR-MMP__names__adjective}?
Constraint: Even if you are {#uncertain|not sure!}, you must pick either {%multiple_choice_enum%2%aA1} without using any {#other|additional!} words.
Options:
{toxicity_SR-MMP%}
Answer: {%multiple_choice_result} | Task: Please answer the multiple choice question.
Question: Is the molecule with the SMILES C=CC(C)CCCC(C)(C)O toxic in the Mitochondrial membrane potential assay?
Constraint: Even if you are not sure, you must pick either a or b without using any additional words.
Options:
a.) True
b.) False
Answer: b |
|
TOX28964 | Nc1cc(=O)nc(N)[nH]1 | 0 | train | Nc1cc(=O)nc(N)[nH]1 | [N][C][=C][C][=Branch1][C][=O][N][=C][Branch1][C][N][NH1][Ring1][Branch2] | SWELIMKTDYHAOY-UHFFFAOYSA-N | 2,6-diamino-1H-pyrimidin-4-one | Task: Please answer the multiple choice question.
Question: Is the molecule with the {SMILES__description} {#representation of |!}{SMILES#} {toxicity_SR-MMP__names__adjective}?
Constraint: Even if you are {#uncertain|not sure!}, you must pick either {%multiple_choice_enum%2%aA1} without using any {#other|additional!} words.
Options:
{toxicity_SR-MMP%}
Answer: {%multiple_choice_result} | Task: Please answer the multiple choice question.
Question: Is the molecule with the SMILES Nc1cc(=O)nc(N)[nH]1 toxic in the SR-MMP assay?
Constraint: Even if you are not sure, you must pick either a or b without using any additional words.
Options:
a False
b True
Answer: a |
|
TOX5603 | CNCCO | 0 | train | CNCCO | [C][N][C][C][O] | OPKOKAMJFNKNAS-UHFFFAOYSA-N | 2-(methylamino)ethanol | Task: Please answer the multiple choice question.
Question: Is the molecule with the {SMILES__description} {#representation of |!}{SMILES#} {toxicity_SR-MMP__names__adjective}?
Constraint: Even if you are {#uncertain|not sure!}, you must pick either {%multiple_choice_enum%2%aA1} without using any {#other|additional!} words.
Options:
{toxicity_SR-MMP%}
Answer: {%multiple_choice_result} | Task: Please answer the multiple choice question.
Question: Is the molecule with the SMILES representation of CNCCO toxic in the SR-Mitochondrial membrane potential assay?
Constraint: Even if you are not sure, you must pick either a or b without using any additional words.
Options:
a. False
b. True
Answer: a |
|
TOX29390 | CC(C)=CCC1=C(O)C(=O)c2ccccc2C1=O | 1 | train | CC(C)=CCC1=C(O)C(=O)c2ccccc2C1=O | [C][C][Branch1][C][C][=C][C][C][=C][Branch1][C][O][C][=Branch1][C][=O][C][=C][C][=C][C][=C][Ring1][=Branch1][C][Ring1][N][=O] | CIEYTVIYYGTCCI-UHFFFAOYSA-N | 2-(3-methylbut-2-enyl)-3-oxidanyl-naphthalene-1,4-dione | Task: Please answer the multiple choice question.
Question: Is the molecule with the {SMILES__description} {#representation of |!}{SMILES#} {toxicity_SR-MMP__names__adjective}?
Constraint: Even if you are {#uncertain|not sure!}, you must pick either {%multiple_choice_enum%2%aA1} without using any {#other|additional!} words.
Options:
{toxicity_SR-MMP%}
Answer: {%multiple_choice_result} | Task: Please answer the multiple choice question.
Question: Is the molecule with the SMILES CC(C)=CCC1=C(O)C(=O)c2ccccc2C1=O toxic in the Mitochondrial membrane potential assay?
Constraint: Even if you are uncertain, you must pick either a or b without using any other words.
Options:
[a] True
[b] False
Answer: a |
|
TOX3122 | CN1C(=O)C(C)(C2=CCCCC2)C(=O)N=C1O | 0 | train | CN1C(=O)C(C)(C2=CCCCC2)C(=O)N=C1O | [C][N][C][=Branch1][C][=O][C][Branch1][C][C][Branch1][=Branch2][C][=C][C][C][C][C][Ring1][=Branch1][C][=Branch1][C][=O][N][=C][Ring1][#C][O] | UYXAWHWODHRRMR-UHFFFAOYSA-N | 5-(cyclohexen-1-yl)-1,5-dimethyl-2-oxidanyl-pyrimidine-4,6-dione | Task: Please answer the multiple choice question.
Question: Is the molecule with the {SMILES__description} {#representation of |!}{SMILES#} {toxicity_SR-MMP__names__adjective}?
Constraint: Even if you are {#uncertain|not sure!}, you must pick either {%multiple_choice_enum%2%aA1} without using any {#other|additional!} words.
Options:
{toxicity_SR-MMP%}
Answer: {%multiple_choice_result} | Task: Please answer the multiple choice question.
Question: Is the molecule with the SMILES CN1C(=O)C(C)(C2=CCCCC2)C(=O)N=C1O toxic in the SR-MMP assay?
Constraint: Even if you are uncertain, you must pick either a or b without using any additional words.
Options:
(a) True
(b) False
Answer: b |
|
TOX2647 | NS(=O)(=O)c1cc2c(cc1C(F)(F)F)NC(Cc1ccccc1)NS2(=O)=O | 0 | train | NS(=O)(=O)c1cc2c(cc1C(F)(F)F)NC(Cc1ccccc1)NS2(=O)=O | [N][S][=Branch1][C][=O][=Branch1][C][=O][C][=C][C][=C][Branch1][=N][C][=C][Ring1][=Branch1][C][Branch1][C][F][Branch1][C][F][F][N][C][Branch1][#Branch2][C][C][=C][C][=C][C][=C][Ring1][=Branch1][N][S][Ring2][Ring1][Ring1][=Branch1][C][=O][=O] | HDWIHXWEUNVBIY-UHFFFAOYSA-N | 3-benzyl-1,1-dioxo-6-(trifluoromethyl)-3,4-dihydro-2H-1λ6,2,4-benzothiadiazine-7-sulfonamide | Task: Please answer the multiple choice question.
Question: Is the molecule with the {SMILES__description} {#representation of |!}{SMILES#} {toxicity_SR-MMP__names__adjective}?
Constraint: Even if you are {#uncertain|not sure!}, you must pick either {%multiple_choice_enum%2%aA1} without using any {#other|additional!} words.
Options:
{toxicity_SR-MMP%}
Answer: {%multiple_choice_result} | Task: Please answer the multiple choice question.
Question: Is the molecule with the SMILES NS(=O)(=O)c1cc2c(cc1C(F)(F)F)NC(Cc1ccccc1)NS2(=O)=O toxic in the Mitochondrial membrane potential assay?
Constraint: Even if you are uncertain, you must pick either a or b without using any other words.
Options:
a.) False
b.) True
Answer: a |
|
TOX9698 | O=S(=O)([O-])OOS(=O)(=O)[O-] | 0 | train | O=S(=O)([O-])OOS(=O)(=O)[O-] | [O][=S][=Branch1][C][=O][Branch1][C][O-1][O][O][S][=Branch1][C][=O][=Branch1][C][=O][O-1] | JRKICGRDRMAZLK-UHFFFAOYSA-L | sulfonatooxy sulfate | Task: Please answer the multiple choice question.
Question: Is the molecule with the {SMILES__description} {#representation of |!}{SMILES#} {toxicity_SR-MMP__names__adjective}?
Constraint: Even if you are {#uncertain|not sure!}, you must pick either {%multiple_choice_enum%2%aA1} without using any {#other|additional!} words.
Options:
{toxicity_SR-MMP%}
Answer: {%multiple_choice_result} | Task: Please answer the multiple choice question.
Question: Is the molecule with the SMILES representation of O=S(=O)([O-])OOS(=O)(=O)[O-] toxic in the SR-Mitochondrial membrane potential assay?
Constraint: Even if you are not sure, you must pick either a or b without using any additional words.
Options:
a: True
b: False
Answer: b |
|
TOX26200 | COc1ccc(Cc2cnc(N)nc2N)cc1OC | 0 | train | COc1ccc(Cc2cnc(N)nc2N)cc1OC | [C][O][C][=C][C][=C][Branch1][=C][C][C][=C][N][=C][Branch1][C][N][N][=C][Ring1][#Branch1][N][C][=C][Ring1][#C][O][C] | LDBTVAXGKYIFHO-UHFFFAOYSA-N | 5-[(4,5-dimethoxycyclohexa-1,3,5-trien-1-yl)methyl]pyrimidine-2,4-diamine | Task: Please answer the multiple choice question.
Question: Is the molecule with the {SMILES__description} {#representation of |!}{SMILES#} {toxicity_SR-MMP__names__adjective}?
Constraint: Even if you are {#uncertain|not sure!}, you must pick either {%multiple_choice_enum%2%aA1} without using any {#other|additional!} words.
Options:
{toxicity_SR-MMP%}
Answer: {%multiple_choice_result} | Task: Please answer the multiple choice question.
Question: Is the molecule with the SMILES COc1ccc(Cc2cnc(N)nc2N)cc1OC toxic in the SR-Mitochondrial membrane potential assay?
Constraint: Even if you are uncertain, you must pick either a or b without using any additional words.
Options:
a.) True
b.) False
Answer: b |
|
TOX28874 | NC1(c2ccc(-c3nc4ccn5c(=O)[nH]nc5c4cc3-c3ccccc3)cc2)CCC1 | 1 | train | NC1(c2ccc(-c3nc4ccn5c(=O)[nH]nc5c4cc3-c3ccccc3)cc2)CCC1 | [N][C][Branch2][Ring2][O][C][=C][C][=C][Branch2][Ring1][#C][C][=N][C][C][=C][N][C][=Branch1][C][=O][NH1][N][=C][Ring1][=Branch1][C][=Ring1][#Branch2][C][=C][Ring1][=C][C][=C][C][=C][C][=C][Ring1][=Branch1][C][=C][Ring2][Ring1][#Branch2][C][C][C][Ring2][Ring1][=C] | ULDXWLCXEDXJGE-UHFFFAOYSA-N | 8-[4-(1-aminocyclobutyl)phenyl]-9-phenyl-2H-[1,2,4]triazolo[3,4-f][1,6]naphthyridin-3-one | Task: Please answer the multiple choice question.
Question: Is the molecule with the {SMILES__description} {#representation of |!}{SMILES#} {toxicity_SR-MMP__names__adjective}?
Constraint: Even if you are {#uncertain|not sure!}, you must pick either {%multiple_choice_enum%2%aA1} without using any {#other|additional!} words.
Options:
{toxicity_SR-MMP%}
Answer: {%multiple_choice_result} | Task: Please answer the multiple choice question.
Question: Is the molecule with the SMILES representation of NC1(c2ccc(-c3nc4ccn5c(=O)[nH]nc5c4cc3-c3ccccc3)cc2)CCC1 toxic in the SR-Mitochondrial membrane potential assay?
Constraint: Even if you are uncertain, you must pick either a or b without using any additional words.
Options:
a False
b True
Answer: b |
|
TOX27939 | Oc1ccc(C2(c3ccc(O)cc3)CCCCC2)cc1 | 1 | train | Oc1ccc(C2(c3ccc(O)cc3)CCCCC2)cc1 | [O][C][=C][C][=C][Branch2][Ring1][=Branch1][C][Branch1][N][C][=C][C][=C][Branch1][C][O][C][=C][Ring1][#Branch1][C][C][C][C][C][Ring1][=N][C][=C][Ring2][Ring1][Ring1] | SDDLEVPIDBLVHC-UHFFFAOYSA-N | 4-[1-(4-hydroxyphenyl)cyclohexyl]phenol | Task: Please answer the multiple choice question.
Question: Is the molecule with the {SMILES__description} {#representation of |!}{SMILES#} {toxicity_SR-MMP__names__adjective}?
Constraint: Even if you are {#uncertain|not sure!}, you must pick either {%multiple_choice_enum%2%aA1} without using any {#other|additional!} words.
Options:
{toxicity_SR-MMP%}
Answer: {%multiple_choice_result} | Task: Please answer the multiple choice question.
Question: Is the molecule with the SMILES representation of Oc1ccc(C2(c3ccc(O)cc3)CCCCC2)cc1 toxic in the SR-Mitochondrial membrane potential assay?
Constraint: Even if you are uncertain, you must pick either a or b without using any additional words.
Options:
a) False
b) True
Answer: b |
|
TOX26524 | CCN(CC)C(=O)c1cccnc1 | 0 | train | CCN(CC)C(=O)c1cccnc1 | [C][C][N][Branch1][Ring1][C][C][C][=Branch1][C][=O][C][=C][C][=C][N][=C][Ring1][=Branch1] | NCYVXEGFNDZQCU-UHFFFAOYSA-N | N,N-diethylpyridine-3-carboxamide | Task: Please answer the multiple choice question.
Question: Is the molecule with the {SMILES__description} {#representation of |!}{SMILES#} {toxicity_SR-MMP__names__adjective}?
Constraint: Even if you are {#uncertain|not sure!}, you must pick either {%multiple_choice_enum%2%aA1} without using any {#other|additional!} words.
Options:
{toxicity_SR-MMP%}
Answer: {%multiple_choice_result} | Task: Please answer the multiple choice question.
Question: Is the molecule with the SMILES representation of CCN(CC)C(=O)c1cccnc1 toxic in the SR-Mitochondrial membrane potential assay?
Constraint: Even if you are not sure, you must pick either a or b without using any additional words.
Options:
a True
b False
Answer: b |
|
TOX14357 | O=C(NC(=O)c1c(F)cccc1F)Nc1cc(Cl)c(OC(F)(F)C(F)C(F)(F)F)cc1Cl | 1 | train | O=C(NC(=O)c1c(F)cccc1F)Nc1cc(Cl)c(OC(F)(F)C(F)C(F)(F)F)cc1Cl | [O][=C][Branch2][Ring1][C][N][C][=Branch1][C][=O][C][=C][Branch1][C][F][C][=C][C][=C][Ring1][#Branch1][F][N][C][=C][C][Branch1][C][Cl][=C][Branch2][Ring1][Branch1][O][C][Branch1][C][F][Branch1][C][F][C][Branch1][C][F][C][Branch1][C][F][Branch1][C][F][F][C][=C][Ring1][P][Cl] | PWPJGUXAGUPAHP-UHFFFAOYSA-N | N-[[2,5-dichloro-4-(1,1,2,3,3,3-hexafluoropropoxy)phenyl]carbamoyl]-2,6-difluorobenzamide | Task: Please answer the multiple choice question.
Question: Is the molecule with the {SMILES__description} {#representation of |!}{SMILES#} {toxicity_SR-MMP__names__adjective}?
Constraint: Even if you are {#uncertain|not sure!}, you must pick either {%multiple_choice_enum%2%aA1} without using any {#other|additional!} words.
Options:
{toxicity_SR-MMP%}
Answer: {%multiple_choice_result} | Task: Please answer the multiple choice question.
Question: Is the molecule with the SMILES representation of O=C(NC(=O)c1c(F)cccc1F)Nc1cc(Cl)c(OC(F)(F)C(F)C(F)(F)F)cc1Cl toxic in the Mitochondrial membrane potential assay?
Constraint: Even if you are not sure, you must pick either a or b without using any other words.
Options:
[a] True
[b] False
Answer: a |
|
TOX2904 | CCCCC(=O)O[C@]1(C(=O)CO)[C@H](C)C[C@H]2[C@@H]3CCC4=CC(=O)C=C[C@]4(C)[C@@]3(F)[C@@H](O)C[C@@]21C | 1 | train | CCCCC(=O)O[C@]1(C(=O)CO)[C@H](C)C[C@H]2[C@@H]3CCC4=CC(=O)C=C[C@]4(C)[C@@]3(F)[C@@H](O)C[C@@]21C | [C][C][C][C][C][=Branch1][C][=O][O][C@][Branch1][#Branch1][C][=Branch1][C][=O][C][O][C@H1][Branch1][C][C][C][C@H1][C@@H1][C][C][C][=C][C][=Branch1][C][=O][C][=C][C@][Ring1][#Branch1][Branch1][C][C][C@@][Ring1][N][Branch1][C][F][C@@H1][Branch1][C][O][C][C@@][Ring2][Ring1][C][Ring2][Ring1][#Branch2][C] | SNHRLVCMMWUAJD-OMPPIWKSSA-N | [(8S,9R,10S,11S,13S,14S,16R,17R)-9-fluoro-11-hydroxy-17-(2-hydroxyacetyl)-10,13,16-trimethyl-3-oxo-6,7,8,11,12,14,15,16-octahydrocyclopenta[a]phenanthren-17-yl] pentanoate | Task: Please answer the multiple choice question.
Question: Is the molecule with the {SMILES__description} {#representation of |!}{SMILES#} {toxicity_SR-MMP__names__adjective}?
Constraint: Even if you are {#uncertain|not sure!}, you must pick either {%multiple_choice_enum%2%aA1} without using any {#other|additional!} words.
Options:
{toxicity_SR-MMP%}
Answer: {%multiple_choice_result} | Task: Please answer the multiple choice question.
Question: Is the molecule with the SMILES representation of CCCCC(=O)O[C@]1(C(=O)CO)[C@H](C)C[C@H]2[C@@H]3CCC4=CC(=O)C=C[C@]4(C)[C@@]3(F)[C@@H](O)C[C@@]21C toxic in the SR-Mitochondrial membrane potential assay?
Constraint: Even if you are uncertain, you must pick either a or b without using any other words.
Options:
a) True
b) False
Answer: a |
|
TOX4736 | C=C(C)C1CC=C(C)C(O)C1 | 0 | train | C=C(C)C1CC=C(C)C(O)C1 | [C][=C][Branch1][C][C][C][C][C][=C][Branch1][C][C][C][Branch1][C][O][C][Ring1][Branch2] | BAVONGHXFVOKBV-UHFFFAOYSA-N | 2-methyl-5-prop-1-en-2-ylcyclohex-2-en-1-ol | Task: Please answer the multiple choice question.
Question: Is the molecule with the {SMILES__description} {#representation of |!}{SMILES#} {toxicity_SR-MMP__names__adjective}?
Constraint: Even if you are {#uncertain|not sure!}, you must pick either {%multiple_choice_enum%2%aA1} without using any {#other|additional!} words.
Options:
{toxicity_SR-MMP%}
Answer: {%multiple_choice_result} | Task: Please answer the multiple choice question.
Question: Is the molecule with the SMILES C=C(C)C1CC=C(C)C(O)C1 toxic in the SR-MMP assay?
Constraint: Even if you are uncertain, you must pick either a or b without using any other words.
Options:
a: False
b: True
Answer: a |
|
TOX26022 | CNC1=Nc2ccc(Cl)cc2C(c2ccccc2)=[N+]([O-])C1 | 0 | train | CNC1=Nc2ccc(Cl)cc2C(c2ccccc2)=[N+]([O-])C1 | [C][N][C][=N][C][=C][C][=C][Branch1][C][Cl][C][=C][Ring1][#Branch1][C][Branch1][=Branch2][C][=C][C][=C][C][=C][Ring1][=Branch1][=N+1][Branch1][C][O-1][C][Ring2][Ring1][Ring1] | ANTSCNMPPGJYLG-UHFFFAOYSA-N | 7-chloro-N-methyl-4-oxido-5-phenyl-3H-1,4-benzodiazepin-4-ium-2-amine | Task: Please answer the multiple choice question.
Question: Is the molecule with the {SMILES__description} {#representation of |!}{SMILES#} {toxicity_SR-MMP__names__adjective}?
Constraint: Even if you are {#uncertain|not sure!}, you must pick either {%multiple_choice_enum%2%aA1} without using any {#other|additional!} words.
Options:
{toxicity_SR-MMP%}
Answer: {%multiple_choice_result} | Task: Please answer the multiple choice question.
Question: Is the molecule with the SMILES representation of CNC1=Nc2ccc(Cl)cc2C(c2ccccc2)=[N+]([O-])C1 toxic in the SR-Mitochondrial membrane potential assay?
Constraint: Even if you are not sure, you must pick either a or b without using any additional words.
Options:
[a] True
[b] False
Answer: b |
|
TOX21793 | Cc1nc(C)c(Cl)c(O)c1Cl | 0 | train | Cc1nc(C)c(Cl)c(O)c1Cl | [C][C][=N][C][Branch1][C][C][=C][Branch1][C][Cl][C][Branch1][C][O][=C][Ring1][=Branch2][Cl] | ZDPIZLCVJAAHHR-UHFFFAOYSA-N | 3,5-dichloro-2,6-dimethylpyridin-4-ol | Task: Please answer the multiple choice question.
Question: Is the molecule with the {SMILES__description} {#representation of |!}{SMILES#} {toxicity_SR-MMP__names__adjective}?
Constraint: Even if you are {#uncertain|not sure!}, you must pick either {%multiple_choice_enum%2%aA1} without using any {#other|additional!} words.
Options:
{toxicity_SR-MMP%}
Answer: {%multiple_choice_result} | Task: Please answer the multiple choice question.
Question: Is the molecule with the SMILES Cc1nc(C)c(Cl)c(O)c1Cl toxic in the Mitochondrial membrane potential assay?
Constraint: Even if you are not sure, you must pick either a or b without using any other words.
Options:
a. False
b. True
Answer: a |
|
TOX22218 | CCCCCOC(=O)CCCC | 0 | train | CCCCCOC(=O)CCCC | [C][C][C][C][C][O][C][=Branch1][C][=O][C][C][C][C] | FGPPDYNPZTUNIU-UHFFFAOYSA-N | pentyl pentanoate | Task: Please answer the multiple choice question.
Question: Is the molecule with the {SMILES__description} {#representation of |!}{SMILES#} {toxicity_SR-MMP__names__adjective}?
Constraint: Even if you are {#uncertain|not sure!}, you must pick either {%multiple_choice_enum%2%aA1} without using any {#other|additional!} words.
Options:
{toxicity_SR-MMP%}
Answer: {%multiple_choice_result} | Task: Please answer the multiple choice question.
Question: Is the molecule with the SMILES representation of CCCCCOC(=O)CCCC toxic in the Mitochondrial membrane potential assay?
Constraint: Even if you are uncertain, you must pick either a or b without using any other words.
Options:
(a) False
(b) True
Answer: a |
|
TOX2822 | CCn1nc(C(=O)O)c(=O)c2cc3c(cc21)OCO3 | 0 | train | CCn1nc(C(=O)O)c(=O)c2cc3c(cc21)OCO3 | [C][C][N][N][=C][Branch1][=Branch1][C][=Branch1][C][=O][O][C][=Branch1][C][=O][C][=C][C][=C][Branch1][#Branch1][C][=C][Ring1][=Branch1][Ring1][=C][O][C][O][Ring1][#Branch1] | VDUWPHTZYNWKRN-UHFFFAOYSA-N | 1-ethyl-4-oxo-[1,3]dioxolo[4,5-g]cinnoline-3-carboxylic acid | Task: Please answer the multiple choice question.
Question: Is the molecule with the {SMILES__description} {#representation of |!}{SMILES#} {toxicity_SR-MMP__names__adjective}?
Constraint: Even if you are {#uncertain|not sure!}, you must pick either {%multiple_choice_enum%2%aA1} without using any {#other|additional!} words.
Options:
{toxicity_SR-MMP%}
Answer: {%multiple_choice_result} | Task: Please answer the multiple choice question.
Question: Is the molecule with the SMILES CCn1nc(C(=O)O)c(=O)c2cc3c(cc21)OCO3 toxic in the SR-MMP assay?
Constraint: Even if you are not sure, you must pick either a or b without using any additional words.
Options:
a: False
b: True
Answer: a |
|
TOX7386 | C=CC(=O)OCCCCCCCC(C)C | 0 | train | C=CC(=O)OCCCCCCCC(C)C | [C][=C][C][=Branch1][C][=O][O][C][C][C][C][C][C][C][C][Branch1][C][C][C] | LVGFPWDANALGOY-UHFFFAOYSA-N | 8-methyl-1-prop-2-enoyloxynonane | Task: Please answer the multiple choice question.
Question: Is the molecule with the {SMILES__description} {#representation of |!}{SMILES#} {toxicity_SR-MMP__names__adjective}?
Constraint: Even if you are {#uncertain|not sure!}, you must pick either {%multiple_choice_enum%2%aA1} without using any {#other|additional!} words.
Options:
{toxicity_SR-MMP%}
Answer: {%multiple_choice_result} | Task: Please answer the multiple choice question.
Question: Is the molecule with the SMILES C=CC(=O)OCCCCCCCC(C)C toxic in the Mitochondrial membrane potential assay?
Constraint: Even if you are uncertain, you must pick either a or b without using any additional words.
Options:
a: True
b: False
Answer: b |
|
TOX27149 | CC(C)C1CCC(O)CC1 | 0 | train | CC(C)C1CCC(O)CC1 | [C][C][Branch1][C][C][C][C][C][C][Branch1][C][O][C][C][Ring1][#Branch1] | DKKRDMLKVSKFMJ-UHFFFAOYSA-N | 4-propan-2-ylcyclohexan-1-ol | Task: Please answer the multiple choice question.
Question: Is the molecule with the {SMILES__description} {#representation of |!}{SMILES#} {toxicity_SR-MMP__names__adjective}?
Constraint: Even if you are {#uncertain|not sure!}, you must pick either {%multiple_choice_enum%2%aA1} without using any {#other|additional!} words.
Options:
{toxicity_SR-MMP%}
Answer: {%multiple_choice_result} | Task: Please answer the multiple choice question.
Question: Is the molecule with the SMILES CC(C)C1CCC(O)CC1 toxic in the SR-Mitochondrial membrane potential assay?
Constraint: Even if you are not sure, you must pick either a or b without using any additional words.
Options:
(a) False
(b) True
Answer: a |
|
TOX15286 | CC/C=C/CCCCCCCCCCOC(C)=O | 0 | train | CC/C=C/CCCCCCCCCCOC(C)=O | [C][C][/C][=C][/C][C][C][C][C][C][C][C][C][C][O][C][Branch1][C][C][=O] | YJINQJFQLQIYHX-SNAWJCMRSA-N | [(E)-tetradec-11-enyl] acetate | Task: Please answer the multiple choice question.
Question: Is the molecule with the {SMILES__description} {#representation of |!}{SMILES#} {toxicity_SR-MMP__names__adjective}?
Constraint: Even if you are {#uncertain|not sure!}, you must pick either {%multiple_choice_enum%2%aA1} without using any {#other|additional!} words.
Options:
{toxicity_SR-MMP%}
Answer: {%multiple_choice_result} | Task: Please answer the multiple choice question.
Question: Is the molecule with the SMILES CC/C=C/CCCCCCCCCCOC(C)=O toxic in the SR-Mitochondrial membrane potential assay?
Constraint: Even if you are uncertain, you must pick either a or b without using any additional words.
Options:
a) True
b) False
Answer: b |
|
TOX7639 | CCCOCCOCCO | 0 | train | CCCOCCOCCO | [C][C][C][O][C][C][O][C][C][O] | DJCYDDALXPHSHR-UHFFFAOYSA-N | 2-(2-propoxyethoxy)ethanol | Task: Please answer the multiple choice question.
Question: Is the molecule with the {SMILES__description} {#representation of |!}{SMILES#} {toxicity_SR-MMP__names__adjective}?
Constraint: Even if you are {#uncertain|not sure!}, you must pick either {%multiple_choice_enum%2%aA1} without using any {#other|additional!} words.
Options:
{toxicity_SR-MMP%}
Answer: {%multiple_choice_result} | Task: Please answer the multiple choice question.
Question: Is the molecule with the SMILES representation of CCCOCCOCCO toxic in the SR-MMP assay?
Constraint: Even if you are not sure, you must pick either a or b without using any other words.
Options:
a: True
b: False
Answer: b |
|
TOX26697 | C[C@H]1COc2c(C3(N)CC3)c(F)cc3c(=O)c(C(=O)O)cn1c23 | 0 | train | C[C@H]1COc2c(C3(N)CC3)c(F)cc3c(=O)c(C(=O)O)cn1c23 | [C][C@H1][C][O][C][=C][Branch1][=Branch2][C][Branch1][C][N][C][C][Ring1][Ring2][C][Branch1][C][F][=C][C][C][=Branch1][C][=O][C][Branch1][=Branch1][C][=Branch1][C][=O][O][=C][N][Ring2][Ring1][Branch1][C][Ring2][Ring1][Ring1][=Ring1][#Branch2] | XAGMUUZPGZWTRP-ZETCQYMHSA-N | (2S)-6-(1-aminocyclopropyl)-7-fluoro-2-methyl-10-oxo-4-oxa-1-azatricyclo[7.3.1.05,13]trideca-5(13),6,8,11-tetraene-11-carboxylic acid | Task: Please answer the multiple choice question.
Question: Is the molecule with the {SMILES__description} {#representation of |!}{SMILES#} {toxicity_SR-MMP__names__adjective}?
Constraint: Even if you are {#uncertain|not sure!}, you must pick either {%multiple_choice_enum%2%aA1} without using any {#other|additional!} words.
Options:
{toxicity_SR-MMP%}
Answer: {%multiple_choice_result} | Task: Please answer the multiple choice question.
Question: Is the molecule with the SMILES C[C@H]1COc2c(C3(N)CC3)c(F)cc3c(=O)c(C(=O)O)cn1c23 toxic in the SR-Mitochondrial membrane potential assay?
Constraint: Even if you are not sure, you must pick either a or b without using any other words.
Options:
a. True
b. False
Answer: b |
|
TOX6178 | O=c1nc([O-])n(Cl)c(=O)n1Cl | 0 | train | O=c1nc([O-])n(Cl)c(=O)n1Cl | [O][=C][N][=C][Branch1][C][O-1][N][Branch1][C][Cl][C][=Branch1][C][=O][N][Ring1][=Branch2][Cl] | CEJLBZWIKQJOAT-UHFFFAOYSA-M | 1,5-dichloro-4,6-dioxo-1,3,5-triazin-2-olate | Task: Please answer the multiple choice question.
Question: Is the molecule with the {SMILES__description} {#representation of |!}{SMILES#} {toxicity_SR-MMP__names__adjective}?
Constraint: Even if you are {#uncertain|not sure!}, you must pick either {%multiple_choice_enum%2%aA1} without using any {#other|additional!} words.
Options:
{toxicity_SR-MMP%}
Answer: {%multiple_choice_result} | Task: Please answer the multiple choice question.
Question: Is the molecule with the SMILES O=c1nc([O-])n(Cl)c(=O)n1Cl toxic in the SR-MMP assay?
Constraint: Even if you are uncertain, you must pick either a or b without using any additional words.
Options:
a: False
b: True
Answer: a |
|
TOX17708 | O=C([O-])C(F)(F)C(F)(F)C(F)(F)C(F)(F)C(F)(F)C(F)(F)C(F)(F)F | 0 | train | O=C([O-])C(F)(F)C(F)(F)C(F)(F)C(F)(F)C(F)(F)C(F)(F)C(F)(F)F | [O][=C][Branch1][C][O-1][C][Branch1][C][F][Branch1][C][F][C][Branch1][C][F][Branch1][C][F][C][Branch1][C][F][Branch1][C][F][C][Branch1][C][F][Branch1][C][F][C][Branch1][C][F][Branch1][C][F][C][Branch1][C][F][Branch1][C][F][C][Branch1][C][F][Branch1][C][F][F] | SNGREZUHAYWORS-UHFFFAOYSA-M | 2,2,3,3,4,4,5,5,6,6,7,7,8,8,8-pentadecafluorooctanoate | Task: Please answer the multiple choice question.
Question: Is the molecule with the {SMILES__description} {#representation of |!}{SMILES#} {toxicity_SR-MMP__names__adjective}?
Constraint: Even if you are {#uncertain|not sure!}, you must pick either {%multiple_choice_enum%2%aA1} without using any {#other|additional!} words.
Options:
{toxicity_SR-MMP%}
Answer: {%multiple_choice_result} | Task: Please answer the multiple choice question.
Question: Is the molecule with the SMILES representation of O=C([O-])C(F)(F)C(F)(F)C(F)(F)C(F)(F)C(F)(F)C(F)(F)C(F)(F)F toxic in the SR-MMP assay?
Constraint: Even if you are not sure, you must pick either a or b without using any other words.
Options:
a. False
b. True
Answer: a |
|
TOX25954 | CCOC(=O)C1=C[C@@H](OC(CC)CC)[C@H](NC(C)=O)[C@@H](N)C1 | 0 | train | CCOC(=O)C1=C[C@@H](OC(CC)CC)[C@H](NC(C)=O)[C@@H](N)C1 | [C][C][O][C][=Branch1][C][=O][C][=C][C@@H1][Branch1][=Branch2][O][C][Branch1][Ring1][C][C][C][C][C@H1][Branch1][#Branch1][N][C][Branch1][C][C][=O][C@@H1][Branch1][C][N][C][Ring1][P] | VSZGPKBBMSAYNT-RRFJBIMHSA-N | ethyl (3R,4R,5S)-4-acetamido-5-amino-3-pentan-3-yloxycyclohexene-1-carboxylate | Task: Please answer the multiple choice question.
Question: Is the molecule with the {SMILES__description} {#representation of |!}{SMILES#} {toxicity_SR-MMP__names__adjective}?
Constraint: Even if you are {#uncertain|not sure!}, you must pick either {%multiple_choice_enum%2%aA1} without using any {#other|additional!} words.
Options:
{toxicity_SR-MMP%}
Answer: {%multiple_choice_result} | Task: Please answer the multiple choice question.
Question: Is the molecule with the SMILES representation of CCOC(=O)C1=C[C@@H](OC(CC)CC)[C@H](NC(C)=O)[C@@H](N)C1 toxic in the SR-Mitochondrial membrane potential assay?
Constraint: Even if you are not sure, you must pick either a or b without using any other words.
Options:
[a] False
[b] True
Answer: a |
|
TOX25603 | CO/N=C(\C(=O)N[C@@H]1C(=O)N2C(C(=O)O)=C(C[N+]3(C)CCCC3)CS[C@H]12)c1csc(N)n1 | 0 | train | CO/N=C(\C(=O)N[C@@H]1C(=O)N2C(C(=O)O)=C(C[N+]3(C)CCCC3)CS[C@H]12)c1csc(N)n1 | [C][O][/N][=C][Branch2][Ring2][#Branch2][\C][=Branch1][C][=O][N][C@@H1][C][=Branch1][C][=O][N][C][Branch1][=Branch1][C][=Branch1][C][=O][O][=C][Branch1][N][C][N+1][Branch1][C][C][C][C][C][C][Ring1][=Branch1][C][S][C@H1][Ring2][Ring1][Ring1][Ring1][S][C][=C][S][C][Branch1][C][N][=N][Ring1][=Branch1] | HVFLCNVBZFFHBT-ZKDACBOMSA-O | (6R,7R)-7-[[(2Z)-2-(2-amino-1,3-thiazol-4-yl)-2-methoxyiminoacetyl]amino]-3-[(1-methylpyrrolidin-1-ium-1-yl)methyl]-8-oxo-5-thia-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylic acid | Task: Please answer the multiple choice question.
Question: Is the molecule with the {SMILES__description} {#representation of |!}{SMILES#} {toxicity_SR-MMP__names__adjective}?
Constraint: Even if you are {#uncertain|not sure!}, you must pick either {%multiple_choice_enum%2%aA1} without using any {#other|additional!} words.
Options:
{toxicity_SR-MMP%}
Answer: {%multiple_choice_result} | Task: Please answer the multiple choice question.
Question: Is the molecule with the SMILES representation of CO/N=C(\C(=O)N[C@@H]1C(=O)N2C(C(=O)O)=C(C[N+]3(C)CCCC3)CS[C@H]12)c1csc(N)n1 toxic in the SR-Mitochondrial membrane potential assay?
Constraint: Even if you are uncertain, you must pick either a or b without using any additional words.
Options:
a.) True
b.) False
Answer: b |
|
TOX1391 | Cc1ccc(OP(=O)(Oc2ccc(C)cc2)Oc2ccc(C)cc2)cc1 | 1 | train | Cc1ccc(OP(=O)(Oc2ccc(C)cc2)Oc2ccc(C)cc2)cc1 | [C][C][=C][C][=C][Branch2][Ring1][S][O][P][=Branch1][C][=O][Branch1][=N][O][C][=C][C][=C][Branch1][C][C][C][=C][Ring1][#Branch1][O][C][=C][C][=C][Branch1][C][C][C][=C][Ring1][#Branch1][C][=C][Ring2][Ring1][=Branch2] | BOSMZFBHAYFUBJ-UHFFFAOYSA-N | tris(4-methylphenyl)phosphate | Task: Please answer the multiple choice question.
Question: Is the molecule with the {SMILES__description} {#representation of |!}{SMILES#} {toxicity_SR-MMP__names__adjective}?
Constraint: Even if you are {#uncertain|not sure!}, you must pick either {%multiple_choice_enum%2%aA1} without using any {#other|additional!} words.
Options:
{toxicity_SR-MMP%}
Answer: {%multiple_choice_result} | Task: Please answer the multiple choice question.
Question: Is the molecule with the SMILES representation of Cc1ccc(OP(=O)(Oc2ccc(C)cc2)Oc2ccc(C)cc2)cc1 toxic in the Mitochondrial membrane potential assay?
Constraint: Even if you are not sure, you must pick either a or b without using any additional words.
Options:
a.) True
b.) False
Answer: a |
|
TOX3594 | CO[C@@H]1[C@@H](O[C@@H]2O[C@H](C)[C@@H](O[C@H]3C[C@@](C)(O)[C@@H](O)[C@H](C)O3)[C@H](N(C)C)[C@H]2O)[C@@H](CC=O)C[C@@H](C)[C@@H](O[C@@H]2CC[C@H](N(C)C)[C@@H](C)O2)C=CC=CC[C@@H](C)OC(=O)C[C@H]1O | 0 | train | CO[C@@H]1[C@@H](O[C@@H]2O[C@H](C)[C@@H](O[C@H]3C[C@@](C)(O)[C@@H](O)[C@H](C)O3)[C@H](N(C)C)[C@H]2O)[C@@H](CC=O)C[C@@H](C)[C@@H](O[C@@H]2CC[C@H](N(C)C)[C@@H](C)O2)C=CC=CC[C@@H](C)OC(=O)C[C@H]1O | [C][O][C@@H1][C@@H1][Branch2][Ring2][=C][O][C@@H1][O][C@H1][Branch1][C][C][C@@H1][Branch2][Ring1][=Branch1][O][C@H1][C][C@@][Branch1][C][C][Branch1][C][O][C@@H1][Branch1][C][O][C@H1][Branch1][C][C][O][Ring1][#Branch2][C@H1][Branch1][=Branch1][N][Branch1][C][C][C][C@H1][Ring2][Ring1][Branch1][O][C@@H1][Branch1][Ring2][C][C][=O][C][C@@H1][Branch1][C][C][C@@H1][Branch2][Ring1][Ring2][O][C@@H1][C][C][C@H1][Branch1][=Branch1][N][Branch1][C][C][C][C@@H1][Branch1][C][C][O][Ring1][#Branch2][C][=C][C][=C][C][C@@H1][Branch1][C][C][O][C][=Branch1][C][=O][C][C@H1][Ring2][Branch1][Branch2][O] | ACTOXUHEUCPTEW-KXWHMLDXSA-N | 2-[(4R,5S,6S,7R,9R,10R,16R)-6-[(2S,3R,4R,5S,6R)-5-[(2S,4R,5S,6S)-4,5-dihydroxy-4,6-dimethyloxan-2-yl]oxy-4-(dimethylamino)-3-hydroxy-6-methyloxan-2-yl]oxy-10-[(2S,5S,6R)-5-(dimethylamino)-6-methyloxan-2-yl]oxy-4-hydroxy-5-methoxy-9,16-dimethyl-2-oxo-1-oxacyclohexadeca-11,13-dien-7-yl]acetaldehyde | Task: Please answer the multiple choice question.
Question: Is the molecule with the {SMILES__description} {#representation of |!}{SMILES#} {toxicity_SR-MMP__names__adjective}?
Constraint: Even if you are {#uncertain|not sure!}, you must pick either {%multiple_choice_enum%2%aA1} without using any {#other|additional!} words.
Options:
{toxicity_SR-MMP%}
Answer: {%multiple_choice_result} | Task: Please answer the multiple choice question.
Question: Is the molecule with the SMILES representation of CO[C@@H]1[C@@H](O[C@@H]2O[C@H](C)[C@@H](O[C@H]3C[C@@](C)(O)[C@@H](O)[C@H](C)O3)[C@H](N(C)C)[C@H]2O)[C@@H](CC=O)C[C@@H](C)[C@@H](O[C@@H]2CC[C@H](N(C)C)[C@@H](C)O2)C=CC=CC[C@@H](C)OC(=O)C[C@H]1O toxic in the SR-Mitochondrial membrane potential assay?
Constraint: Even if you are not sure, you must pick either a or b without using any additional words.
Options:
a: True
b: False
Answer: b |
|
TOX26023 | NS(=O)(=O)Cc1noc2ccccc12 | 0 | train | NS(=O)(=O)Cc1noc2ccccc12 | [N][S][=Branch1][C][=O][=Branch1][C][=O][C][C][=N][O][C][=C][C][=C][C][=C][Ring1][=Branch2][Ring1][=Branch1] | UBQNRHZMVUUOMG-UHFFFAOYSA-N | 1,2-benzoxazol-3-ylmethanesulfonamide | Task: Please answer the multiple choice question.
Question: Is the molecule with the {SMILES__description} {#representation of |!}{SMILES#} {toxicity_SR-MMP__names__adjective}?
Constraint: Even if you are {#uncertain|not sure!}, you must pick either {%multiple_choice_enum%2%aA1} without using any {#other|additional!} words.
Options:
{toxicity_SR-MMP%}
Answer: {%multiple_choice_result} | Task: Please answer the multiple choice question.
Question: Is the molecule with the SMILES representation of NS(=O)(=O)Cc1noc2ccccc12 toxic in the SR-Mitochondrial membrane potential assay?
Constraint: Even if you are not sure, you must pick either a or b without using any other words.
Options:
a.) False
b.) True
Answer: a |
|
TOX25590 | CO[C@@]1(NC(=O)CSCC#N)C(=O)N2C(C(=O)[O-])=C(CSc3nnnn3C)CS[C@@H]21 | 0 | train | CO[C@@]1(NC(=O)CSCC#N)C(=O)N2C(C(=O)[O-])=C(CSc3nnnn3C)CS[C@@H]21 | [C][O][C@@][Branch1][O][N][C][=Branch1][C][=O][C][S][C][C][#N][C][=Branch1][C][=O][N][C][Branch1][=Branch1][C][=Branch1][C][=O][O-1][=C][Branch1][O][C][S][C][=N][N][=N][N][Ring1][Branch1][C][C][S][C@@H1][Ring1][P][Ring2][Ring1][N] | SNBUBQHDYVFSQF-HIFRSBDPSA-M | (6R,7S)-7-[[2-(cyanomethylsulfanyl)acetyl]amino]-7-methoxy-3-[(1-methyltetrazol-5-yl)sulfanylmethyl]-8-oxo-5-thia-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylate | Task: Please answer the multiple choice question.
Question: Is the molecule with the {SMILES__description} {#representation of |!}{SMILES#} {toxicity_SR-MMP__names__adjective}?
Constraint: Even if you are {#uncertain|not sure!}, you must pick either {%multiple_choice_enum%2%aA1} without using any {#other|additional!} words.
Options:
{toxicity_SR-MMP%}
Answer: {%multiple_choice_result} | Task: Please answer the multiple choice question.
Question: Is the molecule with the SMILES representation of CO[C@@]1(NC(=O)CSCC#N)C(=O)N2C(C(=O)[O-])=C(CSc3nnnn3C)CS[C@@H]21 toxic in the SR-Mitochondrial membrane potential assay?
Constraint: Even if you are not sure, you must pick either a or b without using any additional words.
Options:
(a) False
(b) True
Answer: a |
|
TOX9299 | CCCCCCCCCCCCCCCCCCOCCO | 0 | train | CCCCCCCCCCCCCCCCCCOCCO | [C][C][C][C][C][C][C][C][C][C][C][C][C][C][C][C][C][C][O][C][C][O] | ICIDSZQHPUZUHC-UHFFFAOYSA-N | 2-octadecoxyethanol | Task: Please answer the multiple choice question.
Question: Is the molecule with the {SMILES__description} {#representation of |!}{SMILES#} {toxicity_SR-MMP__names__adjective}?
Constraint: Even if you are {#uncertain|not sure!}, you must pick either {%multiple_choice_enum%2%aA1} without using any {#other|additional!} words.
Options:
{toxicity_SR-MMP%}
Answer: {%multiple_choice_result} | Task: Please answer the multiple choice question.
Question: Is the molecule with the SMILES representation of CCCCCCCCCCCCCCCCCCOCCO toxic in the Mitochondrial membrane potential assay?
Constraint: Even if you are uncertain, you must pick either a or b without using any additional words.
Options:
a.) False
b.) True
Answer: a |
|
TOX27880 | CCCCCCCC[N+](C)(CCCCCCCC)CCCCCCCC.O=S(=O)([O-])C(F)(F)F | 1 | train | CCCCCCCC[N+](C)(CCCCCCCC)CCCCCCCC.O=S(=O)([O-])C(F)(F)F | [C][C][C][C][C][C][C][C][N+1][Branch1][C][C][Branch1][=Branch2][C][C][C][C][C][C][C][C][C][C][C][C][C][C][C][C].[O][=S][=Branch1][C][=O][Branch1][C][O-1][C][Branch1][C][F][Branch1][C][F][F] | WYNCDLDEWVNKJX-UHFFFAOYSA-M | methyl(trioctyl)azanium;trifluoromethanesulfonate | Task: Please answer the multiple choice question.
Question: Is the molecule with the {SMILES__description} {#representation of |!}{SMILES#} {toxicity_SR-MMP__names__adjective}?
Constraint: Even if you are {#uncertain|not sure!}, you must pick either {%multiple_choice_enum%2%aA1} without using any {#other|additional!} words.
Options:
{toxicity_SR-MMP%}
Answer: {%multiple_choice_result} | Task: Please answer the multiple choice question.
Question: Is the molecule with the SMILES CCCCCCCC[N+](C)(CCCCCCCC)CCCCCCCC.O=S(=O)([O-])C(F)(F)F toxic in the Mitochondrial membrane potential assay?
Constraint: Even if you are not sure, you must pick either a or b without using any other words.
Options:
a: True
b: False
Answer: a |
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