compound_id
string | SMILES
string | toxicity_NR-Aromatase
int64 | split
string | SMILES_ORIGINAL
string | IMAGE
image | SELFIES
string | InChIKey
string | IUPAC
string | template_original
string | template
string |
|---|---|---|---|---|---|---|---|---|---|---|
TOX5818 | CN(C(=O)CN(CCO)CC(=O)N(C)C(C)(C)Cc1ccccc1)C(C)(C)Cc1ccccc1 | 0 | train | CN(C(=O)CN(CCO)CC(=O)N(C)C(C)(C)Cc1ccccc1)C(C)(C)Cc1ccccc1 | [C][N][Branch2][Ring2][Branch1][C][=Branch1][C][=O][C][N][Branch1][Ring2][C][C][O][C][C][=Branch1][C][=O][N][Branch1][C][C][C][Branch1][C][C][Branch1][C][C][C][C][=C][C][=C][C][=C][Ring1][=Branch1][C][Branch1][C][C][Branch1][C][C][C][C][=C][C][=C][C][=C][Ring1][=Branch1] | FTLDJPRFCGDUFH-UHFFFAOYSA-N | 2-[2-hydroxyethyl-[2-[methyl-(2-methyl-1-phenylpropan-2-yl)amino]-2-oxoethyl]amino]-N-methyl-N-(2-methyl-1-phenylpropan-2-yl)acetamide | Task: Please answer the multiple choice question.
Question: Which molecules are {toxicity_NR-Aromatase#not &NULL}{toxicity_NR-Aromatase__names__adjective}?
Constraint: You must select none, one or more options from {%multiple_choice_enum%2-5%aA1} without using any {#other|additional!} words.
Options:
{SMILES%toxicity_NR-Aromatase%}
Answer: {%multiple_choice_result} | Task: Please answer the multiple choice question.
Question: Which molecules are not toxic in the NR-Aromatase enzyme assay?
Constraint: You must select none, one or more options from a, b, c, d, or e without using any other words.
Options:
a.) CCCNC(C)C(=O)Nc1c(C)csc1C(=O)OC
b.) CCN1CCN(c2cc(-c3ccc(F)cc3)c3c(n2)CCCCCC3)CC1
c.) CN(C(=O)CN(CCO)CC(=O)N(C)C(C)(C)Cc1ccccc1)C(C)(C)Cc1ccccc1
d.) CCCCCCCCCCCCCCCCCC(=O)OCCO
e.) CCCC[n+]1ccccc1.O=S(=O)([O-])C(F)(F)F
Answer: a, b, c, d, e |
|
TOX5886 | CCOC(=O)C1OC1c1ccccc1 | 0 | train | CCOC(=O)C1OC1c1ccccc1 | [C][C][O][C][=Branch1][C][=O][C][O][C][Ring1][Ring1][C][=C][C][=C][C][=C][Ring1][=Branch1] | GOMAKLPNAAZVCJ-UHFFFAOYSA-N | ethyl 3-phenyloxirane-2-carboxylate | Task: Please answer the multiple choice question.
Question: Which molecules are {toxicity_NR-Aromatase#not &NULL}{toxicity_NR-Aromatase__names__adjective}?
Constraint: You must select none, one or more options from {%multiple_choice_enum%2-5%aA1} without using any {#other|additional!} words.
Options:
{SMILES%toxicity_NR-Aromatase%}
Answer: {%multiple_choice_result} | Task: Please answer the multiple choice question.
Question: Which molecules are not toxic in the Aromatase enzyme assay?
Constraint: You must select none, one or more options from a, b, or c without using any other words.
Options:
[a] CNC1(C)C2CCC(C2)C1(C)C
[b] CCOC(=O)C1OC1c1ccccc1
[c] Brc1ccccc1-c1ccccc1
Answer: a, b, c |
|
TOX2109 | CCCCCCC1CCC(=O)O1 | 0 | train | CCCCCCC1CCC(=O)O1 | [C][C][C][C][C][C][C][C][C][C][=Branch1][C][=O][O][Ring1][=Branch1] | IFYYFLINQYPWGJ-UHFFFAOYSA-N | 5-hexyloxolan-2-one | Task: Please answer the multiple choice question.
Question: Which molecules are {toxicity_NR-Aromatase#not &NULL}{toxicity_NR-Aromatase__names__adjective}?
Constraint: You must select none, one or more options from {%multiple_choice_enum%2-5%aA1} without using any {#other|additional!} words.
Options:
{SMILES%toxicity_NR-Aromatase%}
Answer: {%multiple_choice_result} | Task: Please answer the multiple choice question.
Question: Which molecules are not toxic in the Aromatase enzyme assay?
Constraint: You must select none, one or more options from a, b, or c without using any additional words.
Options:
a. CCCCCCC1CCC(=O)O1
b. COC(=O)CCc1ccc(OCC(O)CNC(C)C)cc1
c. O=C(O)COC(=O)Cc1ccccc1Nc1c(Cl)cccc1Cl
Answer: a, b, c |
|
TOX26165 | [O-][n+]1cc[n+]([O-])c2ccccc21 | 0 | train | [O-][n+]1cc[n+]([O-])c2ccccc21 | [O-1][N+1][=C][C][=N+1][Branch1][C][O-1][C][=C][C][=C][C][=C][Ring1][=Branch1][Ring1][O] | CKIHZSGJPSDCNC-UHFFFAOYSA-N | 1,4-dioxidoquinoxaline-1,4-diium | Task: Please answer the multiple choice question.
Question: Which molecules are {toxicity_NR-Aromatase#not &NULL}{toxicity_NR-Aromatase__names__adjective}?
Constraint: You must select none, one or more options from {%multiple_choice_enum%2-5%aA1} without using any {#other|additional!} words.
Options:
{SMILES%toxicity_NR-Aromatase%}
Answer: {%multiple_choice_result} | Task: Please answer the multiple choice question.
Question: Which molecules are not toxic in the NR-Aromatase enzyme assay?
Constraint: You must select none, one or more options from a, b, or c without using any additional words.
Options:
a. CC1CCC(=O)O1
b. [O-][n+]1cc[n+]([O-])c2ccccc21
c. CCCn1cc[n+](C)c1.F[B-](F)(F)F
Answer: a, b, c |
|
TOX2070 | CCCCCCCCCCCC(C)=O | 0 | train | CCCCCCCCCCCC(C)=O | [C][C][C][C][C][C][C][C][C][C][C][C][Branch1][C][C][=O] | CYIFVRUOHKNECG-UHFFFAOYSA-N | tridecan-2-one | Task: Please answer the multiple choice question.
Question: Which molecules are {toxicity_NR-Aromatase#not &NULL}{toxicity_NR-Aromatase__names__adjective}?
Constraint: You must select none, one or more options from {%multiple_choice_enum%2-5%aA1} without using any {#other|additional!} words.
Options:
{SMILES%toxicity_NR-Aromatase%}
Answer: {%multiple_choice_result} | Task: Please answer the multiple choice question.
Question: Which molecules are not toxic in the NR-Aromatase enzyme assay?
Constraint: You must select none, one or more options from a, b, c, d, or e without using any other words.
Options:
a CN1CCN(C(c2ccccc2)c2ccccc2)CC1
b CCCCCCCCCCCC(C)=O
c O=C(O)COc1ccc(Cl)cc1Cl
d C=C(C)C(=O)OCCNC(C)(C)C
e O=C(NO)C1(NS(=O)(=O)c2ccc(Oc3ccc(F)cc3)cc2)CCOCC1
Answer: a, b, c, d, e |
|
TOX5096 | COC(=O)CCCCC(=O)OC | 0 | train | COC(=O)CCCCC(=O)OC | [C][O][C][=Branch1][C][=O][C][C][C][C][C][=Branch1][C][=O][O][C] | UDSFAEKRVUSQDD-UHFFFAOYSA-N | dimethylhexanedioate | Task: Please answer the multiple choice question.
Question: Which molecules are {toxicity_NR-Aromatase#not &NULL}{toxicity_NR-Aromatase__names__adjective}?
Constraint: You must select none, one or more options from {%multiple_choice_enum%2-5%aA1} without using any {#other|additional!} words.
Options:
{SMILES%toxicity_NR-Aromatase%}
Answer: {%multiple_choice_result} | Task: Please answer the multiple choice question.
Question: Which molecules are not toxic in the Aromatase enzyme assay?
Constraint: You must select none, one or more options from a, b, or c without using any other words.
Options:
a. CCN(C)N=O
b. CN(C)CCC#N
c. COC(=O)CCCCC(=O)OC
Answer: a, b, c |
|
TOX326 | O=[Cr]O[Cr]=O | 0 | train | O=[Cr]O[Cr]=O | [O][=Cr][O][Cr][=O] | QDOXWKRWXJOMAK-UHFFFAOYSA-N | oxo(oxochromiooxy)chromium | Task: Please answer the multiple choice question.
Question: Which molecules are {toxicity_NR-Aromatase#not &NULL}{toxicity_NR-Aromatase__names__adjective}?
Constraint: You must select none, one or more options from {%multiple_choice_enum%2-5%aA1} without using any {#other|additional!} words.
Options:
{SMILES%toxicity_NR-Aromatase%}
Answer: {%multiple_choice_result} | Task: Please answer the multiple choice question.
Question: Which molecules are not toxic in the NR-Aromatase enzyme assay?
Constraint: You must select none, one or more options from a, b, c, d, or e without using any additional words.
Options:
a Cc1nc(C)c(Cl)c(O)c1Cl
b Cc1cc(O)ccc1Cl
c N[C@@H](CS)C(=O)O
d NCC1CCC(C(=O)O)CC1
e O=[Cr]O[Cr]=O
Answer: a, b, c, d, e |
|
TOX27641 | CCCCCCCCCCCCOC(C)=O | 0 | train | CCCCCCCCCCCCOC(C)=O | [C][C][C][C][C][C][C][C][C][C][C][C][O][C][Branch1][C][C][=O] | VZWGRQBCURJOMT-UHFFFAOYSA-N | dodecyl acetate | Task: Please answer the multiple choice question.
Question: Which molecules are {toxicity_NR-Aromatase#not &NULL}{toxicity_NR-Aromatase__names__adjective}?
Constraint: You must select none, one or more options from {%multiple_choice_enum%2-5%aA1} without using any {#other|additional!} words.
Options:
{SMILES%toxicity_NR-Aromatase%}
Answer: {%multiple_choice_result} | Task: Please answer the multiple choice question.
Question: Which molecules are not toxic in the NR-Aromatase enzyme assay?
Constraint: You must select none, one or more options from a, b, c, d, or e without using any other words.
Options:
[a] Cl/C(=C\n1cncn1)c1ccc(Cl)cc1Cl
[b] Cc1cc(N)c(S(=O)(=O)O)cc1Cl
[c] CC1(C)CCC(C)(C)c2cc(NC(=O)c3ccc(C(=O)O)cc3)ccc21
[d] CCCCCCCCCCCCOC(C)=O
[e] CCCCCCCCCCCl
Answer: b, d, e |
|
TOX1170 | CN1C(C(=O)Nc2ccccn2)=C(O)c2ccccc2S1(=O)=O | 0 | train | CN1C(C(=O)Nc2ccccn2)=C(O)c2ccccc2S1(=O)=O | [C][N][C][Branch1][=C][C][=Branch1][C][=O][N][C][=C][C][=C][C][=N][Ring1][=Branch1][=C][Branch1][C][O][C][=C][C][=C][C][=C][Ring1][=Branch1][S][Ring2][Ring1][Ring2][=Branch1][C][=O][=O] | QYSPLQLAKJAUJT-UHFFFAOYSA-N | 4-hydroxy-2-methyl-1,1-dioxo-N-pyridin-2-yl-1λ6,2-benzothiazine-3-carboxamide | Task: Please answer the multiple choice question.
Question: Which molecules are {toxicity_NR-Aromatase#not &NULL}{toxicity_NR-Aromatase__names__adjective}?
Constraint: You must select none, one or more options from {%multiple_choice_enum%2-5%aA1} without using any {#other|additional!} words.
Options:
{SMILES%toxicity_NR-Aromatase%}
Answer: {%multiple_choice_result} | Task: Please answer the multiple choice question.
Question: Which molecules are not toxic in the NR-Aromatase enzyme assay?
Constraint: You must select none, one or more options from a, b, c, or d without using any other words.
Options:
[a] O=S(=O)(O)c1ccc(Cl)cc1
[b] CN1C(C(=O)Nc2ccccn2)=C(O)c2ccccc2S1(=O)=O
[c] O=C(O)CC(=O)C(=O)O
[d] CCC(=O)/C=C/C1C(C)=CCCC1(C)C
Answer: a, b, c, d |
|
TOX26176 | O=C(CCN1CCN(CCO)CC1)N1c2ccccc2Sc2ccc(C(F)(F)F)cc21 | 0 | train | O=C(CCN1CCN(CCO)CC1)N1c2ccccc2Sc2ccc(C(F)(F)F)cc21 | [O][=C][Branch1][S][C][C][N][C][C][N][Branch1][Ring2][C][C][O][C][C][Ring1][=Branch2][N][C][=C][C][=C][C][=C][Ring1][=Branch1][S][C][=C][C][=C][Branch1][=Branch2][C][Branch1][C][F][Branch1][C][F][F][C][=C][Ring1][#Branch2][Ring2][Ring1][C] | KRMKBOUUDPUIDK-UHFFFAOYSA-N | 3-[4-(2-hydroxyethyl)piperazin-1-yl]-1-[2-(trifluoromethyl)phenothiazin-10-yl]propan-1-one | Task: Please answer the multiple choice question.
Question: Which molecules are {toxicity_NR-Aromatase#not &NULL}{toxicity_NR-Aromatase__names__adjective}?
Constraint: You must select none, one or more options from {%multiple_choice_enum%2-5%aA1} without using any {#other|additional!} words.
Options:
{SMILES%toxicity_NR-Aromatase%}
Answer: {%multiple_choice_result} | Task: Please answer the multiple choice question.
Question: Which molecules are not toxic in the Aromatase enzyme assay?
Constraint: You must select none, one or more options from a, b, c, d, or e without using any additional words.
Options:
a. CC(=O)Nc1c(I)c(C(=O)[O-])c(I)c(N(C)C(C)=O)c1I
b. N#CCCCl
c. O=C(CCN1CCN(CCO)CC1)N1c2ccccc2Sc2ccc(C(F)(F)F)cc21
d. O=C(CCCN1CCC(n2c(=O)[nH]c3ccccc32)CC1)c1ccc(F)cc1
e. O=C(O)C(=O)O
Answer: a, b, c, d, e |
|
TOX960 | O=[N+]([O-])c1ccc2c3c(cccc13)CC2 | 0 | train | O=[N+]([O-])c1ccc2c3c(cccc13)CC2 | [O][=N+1][Branch1][C][O-1][C][=C][C][=C][C][=C][Branch1][=Branch2][C][=C][C][=C][Ring1][#Branch2][Ring1][=Branch1][C][C][Ring1][=Branch2] | CUARLQDWYSRQDF-UHFFFAOYSA-N | oxido-oxo-(1,2-dihydroacenaphthylen-5-yl)azanium | Task: Please answer the multiple choice question.
Question: Which molecules are {toxicity_NR-Aromatase#not &NULL}{toxicity_NR-Aromatase__names__adjective}?
Constraint: You must select none, one or more options from {%multiple_choice_enum%2-5%aA1} without using any {#other|additional!} words.
Options:
{SMILES%toxicity_NR-Aromatase%}
Answer: {%multiple_choice_result} | Task: Please answer the multiple choice question.
Question: Which molecules are not toxic in the NR-Aromatase enzyme assay?
Constraint: You must select none, one or more options from a, b, or c without using any other words.
Options:
(a) CCCCCCCCOCCC#N
(b) O=[N+]([O-])c1ccc2c3c(cccc13)CC2
(c) O=C(CCCN1CCC(O)(c2cccc(C(F)(F)F)c2)CC1)c1ccc(F)cc1
Answer: a, b, c |
|
TOX4775 | ClCCBr | 0 | train | ClCCBr | [Cl][C][C][Br] | IBYHHJPAARCAIE-UHFFFAOYSA-N | 1-bromo-2-chloroethane | Task: Please answer the multiple choice question.
Question: Which molecules are {toxicity_NR-Aromatase#not &NULL}{toxicity_NR-Aromatase__names__adjective}?
Constraint: You must select none, one or more options from {%multiple_choice_enum%2-5%aA1} without using any {#other|additional!} words.
Options:
{SMILES%toxicity_NR-Aromatase%}
Answer: {%multiple_choice_result} | Task: Please answer the multiple choice question.
Question: Which molecules are not toxic in the NR-Aromatase enzyme assay?
Constraint: You must select none, one or more options from a or b without using any additional words.
Options:
a: ClCCBr
b: O=CNNC=O
Answer: a, b |
|
TOX5709 | [Ni+2].c1cc[cH-]c1.c1cc[cH-]c1 | 0 | train | [Ni+2].c1cc[cH-]c1.c1cc[cH-]c1 | [Ni+2].[C][C][=C][CH1-1][C][=Ring1][Branch1].[C][C][=C][CH1-1][C][=Ring1][Branch1] | KZPXREABEBSAQM-UHFFFAOYSA-N | cyclopenta-1,3-diene;nickel(2+) | Task: Please answer the multiple choice question.
Question: Which molecules are {toxicity_NR-Aromatase#not &NULL}{toxicity_NR-Aromatase__names__adjective}?
Constraint: You must select none, one or more options from {%multiple_choice_enum%2-5%aA1} without using any {#other|additional!} words.
Options:
{SMILES%toxicity_NR-Aromatase%}
Answer: {%multiple_choice_result} | Task: Please answer the multiple choice question.
Question: Which molecules are not toxic in the Aromatase enzyme assay?
Constraint: You must select none, one or more options from a, b, or c without using any other words.
Options:
a.) [Ni+2].c1cc[cH-]c1.c1cc[cH-]c1
b.) CCCCCCCCCCCCSC
c.) CCCCCCCCOC(=O)CCCCCCCCC(=O)OCCCCCCCC
Answer: a, b, c |
|
TOX5523 | Cc1occc(=O)c1O | 0 | train | Cc1occc(=O)c1O | [C][C][O][C][=C][C][=Branch1][C][=O][C][=Ring1][#Branch1][O] | XPCTZQVDEJYUGT-UHFFFAOYSA-N | 3-hydroxy-2-methylpyran-4-one | Task: Please answer the multiple choice question.
Question: Which molecules are {toxicity_NR-Aromatase#not &NULL}{toxicity_NR-Aromatase__names__adjective}?
Constraint: You must select none, one or more options from {%multiple_choice_enum%2-5%aA1} without using any {#other|additional!} words.
Options:
{SMILES%toxicity_NR-Aromatase%}
Answer: {%multiple_choice_result} | Task: Please answer the multiple choice question.
Question: Which molecules are not toxic in the NR-Aromatase enzyme assay?
Constraint: You must select none, one or more options from a or b without using any additional words.
Options:
a Cc1occc(=O)c1O
b N#CC1(N=NC2(C#N)CCCCC2)CCCCC1
Answer: a, b |
|
TOX26187 | OC(c1ccccc1)(c1ccccc1)C1CN2CCC1CC2 | 0 | train | OC(c1ccccc1)(c1ccccc1)C1CN2CCC1CC2 | [O][C][Branch1][=Branch2][C][=C][C][=C][C][=C][Ring1][=Branch1][Branch1][=Branch2][C][=C][C][=C][C][=C][Ring1][=Branch1][C][C][N][C][C][C][Ring1][=Branch1][C][C][Ring1][=Branch1] | PZMAHNDJABQWGS-UHFFFAOYSA-N | 1-azabicyclo[2.2.2]octan-3-yl(diphenyl)methanol | Task: Please answer the multiple choice question.
Question: Which molecules are {toxicity_NR-Aromatase#not &NULL}{toxicity_NR-Aromatase__names__adjective}?
Constraint: You must select none, one or more options from {%multiple_choice_enum%2-5%aA1} without using any {#other|additional!} words.
Options:
{SMILES%toxicity_NR-Aromatase%}
Answer: {%multiple_choice_result} | Task: Please answer the multiple choice question.
Question: Which molecules are not toxic in the Aromatase enzyme assay?
Constraint: You must select none, one or more options from a or b without using any additional words.
Options:
a OC(c1ccccc1)(c1ccccc1)C1CN2CCC1CC2
b C=CCOC(=O)c1ccccc1N
Answer: a, b |
|
TOX2828 | Nc1nc(Cl)nc2c1ncn2[C@H]1C[C@H](O)[C@@H](CO)O1 | 0 | train | Nc1nc(Cl)nc2c1ncn2[C@H]1C[C@H](O)[C@@H](CO)O1 | [N][C][=N][C][Branch1][C][Cl][=N][C][=C][Ring1][#Branch1][N][=C][N][Ring1][Branch1][C@H1][C][C@H1][Branch1][C][O][C@@H1][Branch1][Ring1][C][O][O][Ring1][Branch2] | PTOAARAWEBMLNO-KVQBGUIXSA-N | (2R,3S,5R)-5-(6-amino-2-chloropurin-9-yl)-2-(hydroxymethyl)oxolan-3-ol | Task: Please answer the multiple choice question.
Question: Which molecules are {toxicity_NR-Aromatase#not &NULL}{toxicity_NR-Aromatase__names__adjective}?
Constraint: You must select none, one or more options from {%multiple_choice_enum%2-5%aA1} without using any {#other|additional!} words.
Options:
{SMILES%toxicity_NR-Aromatase%}
Answer: {%multiple_choice_result} | Task: Please answer the multiple choice question.
Question: Which molecules are not toxic in the Aromatase enzyme assay?
Constraint: You must select none, one or more options from a, b, c, d, or e without using any additional words.
Options:
(a) COc1ccc([C@@H]2CC(=O)c3c(O)cc(O[C@@H]4O[C@H](CO[C@@H]5O[C@@H](C)[C@H](O)[C@@H](O)[C@H]5O)[C@@H](O)[C@H](O)[C@H]4O)cc3O2)cc1O
(b) Cc1ccccc1O
(c) O=[N+]([O-])C(Br)(CO)CO
(d) Nc1nc(Cl)nc2c1ncn2[C@H]1C[C@H](O)[C@@H](CO)O1
(e) CCSCc1ccccc1OC(=O)NC
Answer: a, b, c, d, e |
|
TOX26861 | CN1CCC[C@@H]1Cc1c[nH]c2ccc(CCS(=O)(=O)c3ccccc3)cc12 | 0 | train | CN1CCC[C@@H]1Cc1c[nH]c2ccc(CCS(=O)(=O)c3ccccc3)cc12 | [C][N][C][C][C][C@@H1][Ring1][Branch1][C][C][=C][NH1][C][=C][C][=C][Branch2][Ring1][C][C][C][S][=Branch1][C][=O][=Branch1][C][=O][C][=C][C][=C][C][=C][Ring1][=Branch1][C][=C][Ring2][Ring1][Ring2][Ring1][P] | PWVXXGRKLHYWKM-LJQANCHMSA-N | 5-[2-(benzenesulfonyl)ethyl]-3-[[(2R)-1-methylpyrrolidin-2-yl]methyl]-1H-indole | Task: Please answer the multiple choice question.
Question: Which molecules are {toxicity_NR-Aromatase#not &NULL}{toxicity_NR-Aromatase__names__adjective}?
Constraint: You must select none, one or more options from {%multiple_choice_enum%2-5%aA1} without using any {#other|additional!} words.
Options:
{SMILES%toxicity_NR-Aromatase%}
Answer: {%multiple_choice_result} | Task: Please answer the multiple choice question.
Question: Which molecules are not toxic in the NR-Aromatase enzyme assay?
Constraint: You must select none, one or more options from a, b, c, d, or e without using any other words.
Options:
a Nc1ccc(F)cc1F
b CN1CCC[C@@H]1Cc1c[nH]c2ccc(CCS(=O)(=O)c3ccccc3)cc12
c OCCN1CCN(CCCN2c3ccccc3C=Cc3ccccc32)CC1
d c1c[nH]cn1
e CCCCOc1ccc(CC(=O)NO)cc1
Answer: a, b, c, d, e |
|
TOX29002 | CC(C(=O)O)c1ccc2c(c1)CC(=O)c1ccccc1S2 | 0 | train | CC(C(=O)O)c1ccc2c(c1)CC(=O)c1ccccc1S2 | [C][C][Branch1][=Branch1][C][=Branch1][C][=O][O][C][=C][C][=C][C][=Branch1][Ring2][=C][Ring1][=Branch1][C][C][=Branch1][C][=O][C][=C][C][=C][C][=C][Ring1][=Branch1][S][Ring1][=N] | MUXFZBHBYYYLTH-UHFFFAOYSA-N | 2-(6-oxo-5H-benzo[b][1]benzothiepin-3-yl)propanoic acid | Task: Please answer the multiple choice question.
Question: Which molecules are {toxicity_NR-Aromatase#not &NULL}{toxicity_NR-Aromatase__names__adjective}?
Constraint: You must select none, one or more options from {%multiple_choice_enum%2-5%aA1} without using any {#other|additional!} words.
Options:
{SMILES%toxicity_NR-Aromatase%}
Answer: {%multiple_choice_result} | Task: Please answer the multiple choice question.
Question: Which molecules are not toxic in the NR-Aromatase enzyme assay?
Constraint: You must select none, one or more options from a or b without using any additional words.
Options:
a) O=C(O)c1cc(Cl)cc(Cl)c1O
b) CC(C(=O)O)c1ccc2c(c1)CC(=O)c1ccccc1S2
Answer: a, b |
|
TOX12180 | Clc1cc(Cl)c(-c2cc(Cl)c(Cl)cc2Cl)cc1Cl | 0 | train | Clc1cc(Cl)c(-c2cc(Cl)c(Cl)cc2Cl)cc1Cl | [Cl][C][=C][C][Branch1][C][Cl][=C][Branch1][S][C][=C][C][Branch1][C][Cl][=C][Branch1][C][Cl][C][=C][Ring1][Branch2][Cl][C][=C][Ring1][S][Cl] | MVWHGTYKUMDIHL-UHFFFAOYSA-N | 1,2,4-trichloro-5-(3,4,6-trichlorophenyl)benzene | Task: Please answer the multiple choice question.
Question: Which molecules are {toxicity_NR-Aromatase#not &NULL}{toxicity_NR-Aromatase__names__adjective}?
Constraint: You must select none, one or more options from {%multiple_choice_enum%2-5%aA1} without using any {#other|additional!} words.
Options:
{SMILES%toxicity_NR-Aromatase%}
Answer: {%multiple_choice_result} | Task: Please answer the multiple choice question.
Question: Which molecules are not toxic in the Aromatase enzyme assay?
Constraint: You must select none, one or more options from a, b, c, d, or e without using any additional words.
Options:
[a] Cc1ccc([N+](=O)[O-])cc1
[b] CC[N+](C)(CC)CCOC(=O)C1c2ccccc2Oc2ccccc21
[c] CCC1CCC(=O)O1
[d] Clc1cc(Cl)c(-c2cc(Cl)c(Cl)cc2Cl)cc1Cl
[e] CNC.O=C(O)COc1ccc(Cl)cc1Cl
Answer: a, b, c, d, e |
|
TOX540 | O=C(Oc1ccccc1)Oc1ccccc1 | 0 | train | O=C(Oc1ccccc1)Oc1ccccc1 | [O][=C][Branch1][#Branch2][O][C][=C][C][=C][C][=C][Ring1][=Branch1][O][C][=C][C][=C][C][=C][Ring1][=Branch1] | ROORDVPLFPIABK-UHFFFAOYSA-N | diphenylcarbonate | Task: Please answer the multiple choice question.
Question: Which molecules are {toxicity_NR-Aromatase#not &NULL}{toxicity_NR-Aromatase__names__adjective}?
Constraint: You must select none, one or more options from {%multiple_choice_enum%2-5%aA1} without using any {#other|additional!} words.
Options:
{SMILES%toxicity_NR-Aromatase%}
Answer: {%multiple_choice_result} | Task: Please answer the multiple choice question.
Question: Which molecules are not toxic in the NR-Aromatase enzyme assay?
Constraint: You must select none, one or more options from a, b, c, or d without using any additional words.
Options:
a) N#CCCOCCOCCC#N
b) Cc1ccc([N+](=O)[O-])c([N+](=O)[O-])c1
c) CCCCCCCCCCCCCCCC
d) O=C(Oc1ccccc1)Oc1ccccc1
Answer: a, b, c, d |
|
TOX28895 | CC(C)=CCC/C(C)=C/CC/C(C)=C/CC/C(C)=C/CC1=C(C)C(=O)c2ccccc2C1=O | 0 | train | CC(C)=CCC/C(C)=C/CC/C(C)=C/CC/C(C)=C/CC1=C(C)C(=O)c2ccccc2C1=O | [C][C][Branch1][C][C][=C][C][C][/C][Branch1][C][C][=C][/C][C][/C][Branch1][C][C][=C][/C][C][/C][Branch1][C][C][=C][/C][C][=C][Branch1][C][C][C][=Branch1][C][=O][C][=C][C][=C][C][=C][Ring1][=Branch1][C][Ring1][N][=O] | DKHGMERMDICWDU-GHDNBGIDSA-N | 2-methyl-3-[(2E,6E,10E)-3,7,11,15-tetramethylhexadeca-2,6,10,14-tetraenyl]naphthalene-1,4-dione | Task: Please answer the multiple choice question.
Question: Which molecules are {toxicity_NR-Aromatase#not &NULL}{toxicity_NR-Aromatase__names__adjective}?
Constraint: You must select none, one or more options from {%multiple_choice_enum%2-5%aA1} without using any {#other|additional!} words.
Options:
{SMILES%toxicity_NR-Aromatase%}
Answer: {%multiple_choice_result} | Task: Please answer the multiple choice question.
Question: Which molecules are not toxic in the Aromatase enzyme assay?
Constraint: You must select none, one or more options from a, b, c, or d without using any additional words.
Options:
a.) CC(C)=CCC/C(C)=C/CC/C(C)=C/CC/C(C)=C/CC1=C(C)C(=O)c2ccccc2C1=O
b.) CCOc1ccc(NC(=O)OC(C)C)cc1OCC
c.) C=CC1=C(C(=O)O)N2C(=O)[C@@H](NC(=O)/C(=N/OCC(=O)O)c3csc(N)n3)[C@H]2SC1
d.) Nc1ccc(C(=O)O)cc1
Answer: a, b, c, d |
|
TOX25183 | Cc1ccc(=O)n(-c2ccccc2)c1 | 0 | train | Cc1ccc(=O)n(-c2ccccc2)c1 | [C][C][C][=C][C][=Branch1][C][=O][N][Branch1][=Branch2][C][=C][C][=C][C][=C][Ring1][=Branch1][C][=Ring1][=N] | ISWRGOKTTBVCFA-UHFFFAOYSA-N | 5-methyl-1-phenylpyridin-2-one | Task: Please answer the multiple choice question.
Question: Which molecules are {toxicity_NR-Aromatase#not &NULL}{toxicity_NR-Aromatase__names__adjective}?
Constraint: You must select none, one or more options from {%multiple_choice_enum%2-5%aA1} without using any {#other|additional!} words.
Options:
{SMILES%toxicity_NR-Aromatase%}
Answer: {%multiple_choice_result} | Task: Please answer the multiple choice question.
Question: Which molecules are not toxic in the Aromatase enzyme assay?
Constraint: You must select none, one or more options from a, b, c, or d without using any additional words.
Options:
a. CCCC[P+](CCCC)(CCCC)CCCC
b. Cc1ccc(=O)n(-c2ccccc2)c1
c. CCCN[C@H]1CCc2nc(N)sc2C1
d. COc1ccc(OC)c(CC(C)N)c1
Answer: a, b, c, d |
|
TOX24626 | O=c1n(CCCN2CCN(c3cccc(Cl)c3)CC2)nc2ccccn12 | 0 | train | O=c1n(CCCN2CCN(c3cccc(Cl)c3)CC2)nc2ccccn12 | [O][=C][N][Branch2][Ring1][=Branch2][C][C][C][N][C][C][N][Branch1][N][C][=C][C][=C][C][Branch1][C][Cl][=C][Ring1][#Branch1][C][C][Ring1][=N][N][=C][C][=C][C][=C][N][Ring2][Ring1][=Branch2][Ring1][=Branch1] | PHLBKPHSAVXXEF-UHFFFAOYSA-N | 2-[3-[4-(3-chlorophenyl)piperazin-1-yl]propyl]-[1,2,4]triazolo[4,3-a]pyridin-3-one | Task: Please answer the multiple choice question.
Question: Which molecules are {toxicity_NR-Aromatase#not &NULL}{toxicity_NR-Aromatase__names__adjective}?
Constraint: You must select none, one or more options from {%multiple_choice_enum%2-5%aA1} without using any {#other|additional!} words.
Options:
{SMILES%toxicity_NR-Aromatase%}
Answer: {%multiple_choice_result} | Task: Please answer the multiple choice question.
Question: Which molecules are not toxic in the NR-Aromatase enzyme assay?
Constraint: You must select none, one or more options from a, b, c, d, or e without using any additional words.
Options:
a O=c1n(CCCN2CCN(c3cccc(Cl)c3)CC2)nc2ccccn12
b OC[C@@H](O)C(O)[C@H](O)CO
c CCCCCCCCCCCCCCCC(=O)OC[C@H](O)[C@H]1OC(=O)C(O)=C1O
d CN1CCCC1
e COC(=O)COc1ccc(Cl)cc1Cl
Answer: a, b, c, d, e |
|
TOX4368 | CCOCCOCCOCCO | 0 | train | CCOCCOCCOCCO | [C][C][O][C][C][O][C][C][O][C][C][O] | WFSMVVDJSNMRAR-UHFFFAOYSA-N | 2-[2-(2-ethoxyethoxy)ethoxy]ethanol | Task: Please answer the multiple choice question.
Question: Which molecules are {toxicity_NR-Aromatase#not &NULL}{toxicity_NR-Aromatase__names__adjective}?
Constraint: You must select none, one or more options from {%multiple_choice_enum%2-5%aA1} without using any {#other|additional!} words.
Options:
{SMILES%toxicity_NR-Aromatase%}
Answer: {%multiple_choice_result} | Task: Please answer the multiple choice question.
Question: Which molecules are not toxic in the NR-Aromatase enzyme assay?
Constraint: You must select none, one or more options from a, b, c, d, or e without using any other words.
Options:
[a] O=[N+]([O-])c1ccccc1CCO
[b] Cc1ccc(Nc2ccc(O)c3c2C(=O)c2ccccc2C3=O)cc1
[c] NO
[d] CCCC(=O)C(=O)O
[e] CCOCCOCCOCCO
Answer: a, b, c, d, e |
|
TOX1174 | Brc1cc(-c2ccc(Br)c(Br)c2Br)cc(Br)c1Br | 0 | train | Brc1cc(-c2ccc(Br)c(Br)c2Br)cc(Br)c1Br | [Br][C][=C][C][Branch1][S][C][=C][C][=C][Branch1][C][Br][C][Branch1][C][Br][=C][Ring1][Branch2][Br][=C][C][Branch1][C][Br][=C][Ring1][S][Br] | PCEAPJVBSINMNW-UHFFFAOYSA-N | 1,2,3-tribromo-4-(3,4,5-tribromophenyl)benzene | Task: Please answer the multiple choice question.
Question: Which molecules are {toxicity_NR-Aromatase#not &NULL}{toxicity_NR-Aromatase__names__adjective}?
Constraint: You must select none, one or more options from {%multiple_choice_enum%2-5%aA1} without using any {#other|additional!} words.
Options:
{SMILES%toxicity_NR-Aromatase%}
Answer: {%multiple_choice_result} | Task: Please answer the multiple choice question.
Question: Which molecules are not toxic in the NR-Aromatase enzyme assay?
Constraint: You must select none, one or more options from a, b, or c without using any additional words.
Options:
(a) O=S(=O)(O)c1ccc2[nH]c(-c3ccccc3)nc2c1
(b) Brc1cc(-c2ccc(Br)c(Br)c2Br)cc(Br)c1Br
(c) CCC(C)(C)C1CCCCC1OC(C)=O
Answer: a, b, c |
|
TOX5577 | C/C=C(/C)C#N | 0 | train | C/C=C(/C)C#N | [C][/C][=C][Branch1][C][/C][C][#N] | IHXNSHZBFXGOJM-HYXAFXHYSA-N | (Z)-2-methylbut-2-enenitrile | Task: Please answer the multiple choice question.
Question: Which molecules are {toxicity_NR-Aromatase#not &NULL}{toxicity_NR-Aromatase__names__adjective}?
Constraint: You must select none, one or more options from {%multiple_choice_enum%2-5%aA1} without using any {#other|additional!} words.
Options:
{SMILES%toxicity_NR-Aromatase%}
Answer: {%multiple_choice_result} | Task: Please answer the multiple choice question.
Question: Which molecules are not toxic in the Aromatase enzyme assay?
Constraint: You must select none, one or more options from a, b, c, d, or e without using any other words.
Options:
a. Nc1c(Cl)c(F)nc(OCC(=O)O)c1Cl
b. CC(C)(C)C(O)C(Oc1ccc(Cl)cc1)n1cncn1
c. CC1(C)C(=O)N(Cl)C(=O)N1Cl
d. C/C=C(/C)C#N
e. O=C(O)c1ccc2c(c1)C(=O)OC2=O
Answer: a, c, d, e |
|
TOX24799 | CC(C)(C)C1CCCCC1O | 0 | train | CC(C)(C)C1CCCCC1O | [C][C][Branch1][C][C][Branch1][C][C][C][C][C][C][C][C][Ring1][=Branch1][O] | DLTWBMHADAJAAZ-UHFFFAOYSA-N | 2-tert-butylcyclohexan-1-ol | Task: Please answer the multiple choice question.
Question: Which molecules are {toxicity_NR-Aromatase#not &NULL}{toxicity_NR-Aromatase__names__adjective}?
Constraint: You must select none, one or more options from {%multiple_choice_enum%2-5%aA1} without using any {#other|additional!} words.
Options:
{SMILES%toxicity_NR-Aromatase%}
Answer: {%multiple_choice_result} | Task: Please answer the multiple choice question.
Question: Which molecules are not toxic in the Aromatase enzyme assay?
Constraint: You must select none, one or more options from a, b, or c without using any other words.
Options:
[a] O=C(O)CCNC(=O)c1ccc(/N=N/c2ccc(O)c(C(=O)O)c2)cc1
[b] O=C(CCCN1CCC(n2c(=O)[nH]c3ccccc32)CC1)c1ccc(F)cc1
[c] CC(C)(C)C1CCCCC1O
Answer: a, b, c |
|
TOX24448 | C=CCCC(=O)O | 0 | train | C=CCCC(=O)O | [C][=C][C][C][C][=Branch1][C][=O][O] | HVAMZGADVCBITI-UHFFFAOYSA-N | pent-4-enoic acid | Task: Please answer the multiple choice question.
Question: Which molecules are {toxicity_NR-Aromatase#not &NULL}{toxicity_NR-Aromatase__names__adjective}?
Constraint: You must select none, one or more options from {%multiple_choice_enum%2-5%aA1} without using any {#other|additional!} words.
Options:
{SMILES%toxicity_NR-Aromatase%}
Answer: {%multiple_choice_result} | Task: Please answer the multiple choice question.
Question: Which molecules are not toxic in the Aromatase enzyme assay?
Constraint: You must select none, one or more options from a or b without using any other words.
Options:
a.) CC1COc2c(N3CCN(C)CC3)c(F)cc3c(=O)c(C(=O)O)cn1c23
b.) C=CCCC(=O)O
Answer: a, b |
|
TOX4738 | C=C(C)C1CC=C(C)C(OC(C)=O)C1 | 0 | train | C=C(C)C1CC=C(C)C(OC(C)=O)C1 | [C][=C][Branch1][C][C][C][C][C][=C][Branch1][C][C][C][Branch1][#Branch1][O][C][Branch1][C][C][=O][C][Ring1][O] | YTHRBOFHFYZBRJ-UHFFFAOYSA-N | (2-methyl-5-prop-1-en-2-ylcyclohex-2-en-1-yl) acetate | Task: Please answer the multiple choice question.
Question: Which molecules are {toxicity_NR-Aromatase#not &NULL}{toxicity_NR-Aromatase__names__adjective}?
Constraint: You must select none, one or more options from {%multiple_choice_enum%2-5%aA1} without using any {#other|additional!} words.
Options:
{SMILES%toxicity_NR-Aromatase%}
Answer: {%multiple_choice_result} | Task: Please answer the multiple choice question.
Question: Which molecules are not toxic in the Aromatase enzyme assay?
Constraint: You must select none, one or more options from a, b, or c without using any additional words.
Options:
a C=C(C)C1CC=C(C)C(OC(C)=O)C1
b CCN(CC)N(O)N=O.CCNCC
c S=C(Nc1ccccc1)Nc1ccccc1
Answer: a, b, c |
|
TOX6130 | CCC[N+](CCC)(CCC)CCC | 0 | train | CCC[N+](CCC)(CCC)CCC | [C][C][C][N+1][Branch1][Ring2][C][C][C][Branch1][Ring2][C][C][C][C][C][C] | OSBSFAARYOCBHB-UHFFFAOYSA-N | tetrapropylazanium | Task: Please answer the multiple choice question.
Question: Which molecules are {toxicity_NR-Aromatase#not &NULL}{toxicity_NR-Aromatase__names__adjective}?
Constraint: You must select none, one or more options from {%multiple_choice_enum%2-5%aA1} without using any {#other|additional!} words.
Options:
{SMILES%toxicity_NR-Aromatase%}
Answer: {%multiple_choice_result} | Task: Please answer the multiple choice question.
Question: Which molecules are not toxic in the Aromatase enzyme assay?
Constraint: You must select none, one or more options from a, b, c, or d without using any additional words.
Options:
(a) CN(C)CCc1c[nH]c2ccc(CS(=O)(=O)N3CCCC3)cc12
(b) CCC[N+](CCC)(CCC)CCC
(c) CC(C)[C@H](N)C(=O)OCCOCn1cnc2c(=O)[nH]c(N)nc21
(d) CS(=O)(=O)OCC(O)C(O)COS(C)(=O)=O
Answer: a, b, c, d |
|
TOX26137 | Cc1c(C)n(Cc2ccccc2)c2ccc(C(=O)OCCN(C)C)cc12 | 0 | train | Cc1c(C)n(Cc2ccccc2)c2ccc(C(=O)OCCN(C)C)cc12 | [C][C][=C][Branch1][C][C][N][Branch1][#Branch2][C][C][=C][C][=C][C][=C][Ring1][=Branch1][C][=C][C][=C][Branch1][=N][C][=Branch1][C][=O][O][C][C][N][Branch1][C][C][C][C][=C][Ring2][Ring1][=Branch2][Ring1][=C] | YKWQHMLRAPIWDP-UHFFFAOYSA-N | 2-(dimethylamino)ethyl 1-benzyl-2,3-dimethylindole-5-carboxylate | Task: Please answer the multiple choice question.
Question: Which molecules are {toxicity_NR-Aromatase#not &NULL}{toxicity_NR-Aromatase__names__adjective}?
Constraint: You must select none, one or more options from {%multiple_choice_enum%2-5%aA1} without using any {#other|additional!} words.
Options:
{SMILES%toxicity_NR-Aromatase%}
Answer: {%multiple_choice_result} | Task: Please answer the multiple choice question.
Question: Which molecules are not toxic in the NR-Aromatase enzyme assay?
Constraint: You must select none, one or more options from a, b, c, or d without using any additional words.
Options:
a. Cc1c(C)n(Cc2ccccc2)c2ccc(C(=O)OCCN(C)C)cc12
b. CCN(CC)CCc1nc(-c2ccccc2)no1.O=C(O)CC(O)(CC(=O)O)C(=O)O
c. CCCCCCCCCCC=O
d. C=C(C)C(=O)OCCC[Si](Cl)(Cl)Cl
Answer: a, b, c, d |
|
TOX26733 | CCN(CC)CCOC(=O)c1cccnc1.O=C(O)CC(O)(CC(=O)O)C(=O)O | 0 | train | CCN(CC)CCOC(=O)c1cccnc1.O=C(O)CC(O)(CC(=O)O)C(=O)O | [C][C][N][Branch1][Ring1][C][C][C][C][O][C][=Branch1][C][=O][C][=C][C][=C][N][=C][Ring1][=Branch1].[O][=C][Branch1][C][O][C][C][Branch1][C][O][Branch1][#Branch1][C][C][=Branch1][C][=O][O][C][=Branch1][C][=O][O] | IABBAGAOMDWOCW-UHFFFAOYSA-N | 2-(diethylamino)ethyl pyridine-3-carboxylate;2-hydroxypropane-1,2,3-tricarboxylic acid | Task: Please answer the multiple choice question.
Question: Which molecules are {toxicity_NR-Aromatase#not &NULL}{toxicity_NR-Aromatase__names__adjective}?
Constraint: You must select none, one or more options from {%multiple_choice_enum%2-5%aA1} without using any {#other|additional!} words.
Options:
{SMILES%toxicity_NR-Aromatase%}
Answer: {%multiple_choice_result} | Task: Please answer the multiple choice question.
Question: Which molecules are not toxic in the NR-Aromatase enzyme assay?
Constraint: You must select none, one or more options from a, b, c, or d without using any other words.
Options:
a: CCN(CC)CCOC(=O)c1cccnc1.O=C(O)CC(O)(CC(=O)O)C(=O)O
b: COc1ccc(Cl)cc1C
c: Cc1c(N(C)CS(=O)(=O)[O-])c(=O)n(-c2ccccc2)n1C
d: CC(=O)c1ccc(C(C)=O)cc1
Answer: a, b, c, d |
|
TOX25852 | CC(C)NNC(=O)c1ccncc1 | 0 | train | CC(C)NNC(=O)c1ccncc1 | [C][C][Branch1][C][C][N][N][C][=Branch1][C][=O][C][=C][C][=N][C][=C][Ring1][=Branch1] | NYMGNSNKLVNMIA-UHFFFAOYSA-N | N'-propan-2-ylpyridine-4-carbohydrazide | Task: Please answer the multiple choice question.
Question: Which molecules are {toxicity_NR-Aromatase#not &NULL}{toxicity_NR-Aromatase__names__adjective}?
Constraint: You must select none, one or more options from {%multiple_choice_enum%2-5%aA1} without using any {#other|additional!} words.
Options:
{SMILES%toxicity_NR-Aromatase%}
Answer: {%multiple_choice_result} | Task: Please answer the multiple choice question.
Question: Which molecules are not toxic in the Aromatase enzyme assay?
Constraint: You must select none, one or more options from a, b, or c without using any additional words.
Options:
(a) C=CCOCC(CO)(COCC=C)COCC=C
(b) CC(C)NNC(=O)c1ccncc1
(c) CCc1cccc(C)c1N(C(=O)CCl)C(C)COC
Answer: a, b |
|
TOX3846 | COP(=O)(NC(C)=O)SC | 0 | train | COP(=O)(NC(C)=O)SC | [C][O][P][=Branch1][C][=O][Branch1][#Branch1][N][C][Branch1][C][C][=O][S][C] | YASYVMFAVPKPKE-UHFFFAOYSA-N | N-[methoxy(methylsulfanyl)phosphoryl]acetamide | Task: Please answer the multiple choice question.
Question: Which molecules are {toxicity_NR-Aromatase#not &NULL}{toxicity_NR-Aromatase__names__adjective}?
Constraint: You must select none, one or more options from {%multiple_choice_enum%2-5%aA1} without using any {#other|additional!} words.
Options:
{SMILES%toxicity_NR-Aromatase%}
Answer: {%multiple_choice_result} | Task: Please answer the multiple choice question.
Question: Which molecules are not toxic in the Aromatase enzyme assay?
Constraint: You must select none, one or more options from a, b, c, or d without using any other words.
Options:
(a) O=C(O)c1c(Cl)ccc2cc(Cl)cnc12
(b) [N-]=[N+]=C1C=Cc2c(cccc2S(=O)(=O)[O-])C1=O
(c) COP(=O)(NC(C)=O)SC
(d) CC1=CC(O)CC(C)(C)C1
Answer: a, b, c, d |
|
TOX24404 | OCCSSCCO | 0 | train | OCCSSCCO | [O][C][C][S][S][C][C][O] | KYNFOMQIXZUKRK-UHFFFAOYSA-N | 2-(2-hydroxyethyldisulfanyl)ethanol | Task: Please answer the multiple choice question.
Question: Which molecules are {toxicity_NR-Aromatase#not &NULL}{toxicity_NR-Aromatase__names__adjective}?
Constraint: You must select none, one or more options from {%multiple_choice_enum%2-5%aA1} without using any {#other|additional!} words.
Options:
{SMILES%toxicity_NR-Aromatase%}
Answer: {%multiple_choice_result} | Task: Please answer the multiple choice question.
Question: Which molecules are not toxic in the NR-Aromatase enzyme assay?
Constraint: You must select none, one or more options from a, b, or c without using any additional words.
Options:
a.) Nc1c(Cl)cc(Cl)cc1[N+](=O)[O-]
b.) CNC(=O)Oc1ccc(N(C)C)c(C)c1
c.) OCCSSCCO
Answer: b, c |
|
TOX2096 | CCCSSCCC | 0 | train | CCCSSCCC | [C][C][C][S][S][C][C][C] | ALVPFGSHPUPROW-UHFFFAOYSA-N | 1-(propyldisulfanyl)propane | Task: Please answer the multiple choice question.
Question: Which molecules are {toxicity_NR-Aromatase#not &NULL}{toxicity_NR-Aromatase__names__adjective}?
Constraint: You must select none, one or more options from {%multiple_choice_enum%2-5%aA1} without using any {#other|additional!} words.
Options:
{SMILES%toxicity_NR-Aromatase%}
Answer: {%multiple_choice_result} | Task: Please answer the multiple choice question.
Question: Which molecules are not toxic in the Aromatase enzyme assay?
Constraint: You must select none, one or more options from a, b, or c without using any other words.
Options:
a. CCCSSCCC
b. CN(C)S(=O)(=O)N(SC(F)(Cl)Cl)c1ccccc1
c. NC(=O)OCC(O)COc1ccc(Cl)cc1
Answer: a, c |
|
TOX5804 | C=CCCCCCC | 0 | train | C=CCCCCCC | [C][=C][C][C][C][C][C][C] | KWKAKUADMBZCLK-UHFFFAOYSA-N | oct-1-ene | Task: Please answer the multiple choice question.
Question: Which molecules are {toxicity_NR-Aromatase#not &NULL}{toxicity_NR-Aromatase__names__adjective}?
Constraint: You must select none, one or more options from {%multiple_choice_enum%2-5%aA1} without using any {#other|additional!} words.
Options:
{SMILES%toxicity_NR-Aromatase%}
Answer: {%multiple_choice_result} | Task: Please answer the multiple choice question.
Question: Which molecules are not toxic in the NR-Aromatase enzyme assay?
Constraint: You must select none, one or more options from a or b without using any other words.
Options:
a) C=CCCCCCC
b) O=C(O)CCCCCCCCC(=O)O
Answer: a, b |
|
TOX5997 | CC1=C(/C=C/C(C)=C/C=C/C(C)=C\C=O)C(C)(C)CCC1 | 1 | train | CC1=C(/C=C/C(C)=C/C=C/C(C)=C\C=O)C(C)(C)CCC1 | [C][C][=C][Branch1][P][/C][=C][/C][Branch1][C][C][=C][/C][=C][/C][Branch1][C][C][=C][\C][=O][C][Branch1][C][C][Branch1][C][C][C][C][C][Ring2][Ring1][Ring2] | NCYCYZXNIZJOKI-HWCYFHEPSA-N | (2Z,4E,6E,8E)-3,7-dimethyl-9-(2,6,6-trimethylcyclohexen-1-yl)nona-2,4,6,8-tetraenal | Task: Please answer the multiple choice question.
Question: Which molecules are {toxicity_NR-Aromatase#not &NULL}{toxicity_NR-Aromatase__names__adjective}?
Constraint: You must select none, one or more options from {%multiple_choice_enum%2-5%aA1} without using any {#other|additional!} words.
Options:
{SMILES%toxicity_NR-Aromatase%}
Answer: {%multiple_choice_result} | Task: Please answer the multiple choice question.
Question: Which molecules are toxic in the Aromatase enzyme assay?
Constraint: You must select none, one or more options from a, b, or c without using any other words.
Options:
(a) Cc1cc(C)c(NC(=O)CN(CC(=O)O)CC(=O)O)c(C)c1Br
(b) S=C1NCCN1
(c) CC1=C(/C=C/C(C)=C/C=C/C(C)=C\C=O)C(C)(C)CCC1
Answer: c |
|
TOX7596 | COCCCN | 0 | train | COCCCN | [C][O][C][C][C][N] | FAXDZWQIWUSWJH-UHFFFAOYSA-N | 3-methoxypropan-1-amine | Task: Please answer the multiple choice question.
Question: Which molecules are {toxicity_NR-Aromatase#not &NULL}{toxicity_NR-Aromatase__names__adjective}?
Constraint: You must select none, one or more options from {%multiple_choice_enum%2-5%aA1} without using any {#other|additional!} words.
Options:
{SMILES%toxicity_NR-Aromatase%}
Answer: {%multiple_choice_result} | Task: Please answer the multiple choice question.
Question: Which molecules are not toxic in the NR-Aromatase enzyme assay?
Constraint: You must select none, one or more options from a, b, or c without using any other words.
Options:
a) CC(=O)Nc1ccccc1O
b) COCCCN
c) CCCCCC(=O)O
Answer: a, b, c |
|
TOX24424 | NCc1cccnc1 | 0 | train | NCc1cccnc1 | [N][C][C][=C][C][=C][N][=C][Ring1][=Branch1] | HDOUGSFASVGDCS-UHFFFAOYSA-N | pyridin-3-ylmethanamine | Task: Please answer the multiple choice question.
Question: Which molecules are {toxicity_NR-Aromatase#not &NULL}{toxicity_NR-Aromatase__names__adjective}?
Constraint: You must select none, one or more options from {%multiple_choice_enum%2-5%aA1} without using any {#other|additional!} words.
Options:
{SMILES%toxicity_NR-Aromatase%}
Answer: {%multiple_choice_result} | Task: Please answer the multiple choice question.
Question: Which molecules are not toxic in the NR-Aromatase enzyme assay?
Constraint: You must select none, one or more options from a, b, c, d, or e without using any other words.
Options:
a: CN(C)C(=O)Nc1cccc(C(F)(F)F)c1
b: NCc1cccnc1
c: CC1=CC(=O)[N-]S(=O)(=O)O1
d: CCCC(CCC)C(N)=O
e: OCCc1ccncc1
Answer: a, b, c, d, e |
|
TOX13433 | COC1=CC(=O)OC(CCc2ccccc2)C1 | 0 | train | COC1=CC(=O)OC(CCc2ccccc2)C1 | [C][O][C][=C][C][=Branch1][C][=O][O][C][Branch1][O][C][C][C][=C][C][=C][C][=C][Ring1][=Branch1][C][Ring1][#C] | VOOYTQRREPYRIW-UHFFFAOYSA-N | 4-methoxy-2-(2-phenylethyl)-2,3-dihydropyran-6-one | Task: Please answer the multiple choice question.
Question: Which molecules are {toxicity_NR-Aromatase#not &NULL}{toxicity_NR-Aromatase__names__adjective}?
Constraint: You must select none, one or more options from {%multiple_choice_enum%2-5%aA1} without using any {#other|additional!} words.
Options:
{SMILES%toxicity_NR-Aromatase%}
Answer: {%multiple_choice_result} | Task: Please answer the multiple choice question.
Question: Which molecules are not toxic in the Aromatase enzyme assay?
Constraint: You must select none, one or more options from a or b without using any additional words.
Options:
a.) COC1=CC(=O)OC(CCc2ccccc2)C1
b.) O=S(=O)([O-])c1cccc2ccccc12
Answer: a, b |
|
TOX28474 | CCCCCBr | 0 | train | CCCCCBr | [C][C][C][C][C][Br] | YZWKKMVJZFACSU-UHFFFAOYSA-N | 1-bromopentane | Task: Please answer the multiple choice question.
Question: Which molecules are {toxicity_NR-Aromatase#not &NULL}{toxicity_NR-Aromatase__names__adjective}?
Constraint: You must select none, one or more options from {%multiple_choice_enum%2-5%aA1} without using any {#other|additional!} words.
Options:
{SMILES%toxicity_NR-Aromatase%}
Answer: {%multiple_choice_result} | Task: Please answer the multiple choice question.
Question: Which molecules are not toxic in the NR-Aromatase enzyme assay?
Constraint: You must select none, one or more options from a or b without using any other words.
Options:
[a] CCCCCBr
[b] CC(C)NCC(O)c1ccc(N)c(C#N)c1
Answer: a, b |
|
TOX21256 | OCCCCCO | 0 | train | OCCCCCO | [O][C][C][C][C][C][O] | ALQSHHUCVQOPAS-UHFFFAOYSA-N | 5-hydroxypentan-1-ol | Task: Please answer the multiple choice question.
Question: Which molecules are {toxicity_NR-Aromatase#not &NULL}{toxicity_NR-Aromatase__names__adjective}?
Constraint: You must select none, one or more options from {%multiple_choice_enum%2-5%aA1} without using any {#other|additional!} words.
Options:
{SMILES%toxicity_NR-Aromatase%}
Answer: {%multiple_choice_result} | Task: Please answer the multiple choice question.
Question: Which molecules are not toxic in the Aromatase enzyme assay?
Constraint: You must select none, one or more options from a, b, or c without using any other words.
Options:
a) CCCC[N+]1(C)CCCCC1.F[B-](F)(F)F
b) Cc1nnc(C(C)C)n1C1C[C@H]2CC[C@H](C1)N2CC[C@H](NC(=O)C1CCC(F)(F)CC1)c1ccccc1
c) OCCCCCO
Answer: a, b, c |
|
TOX25677 | CC1(C)Oc2ccc(C#N)cc2[C@@H](N2CCCC2=O)[C@@H]1O | 0 | train | CC1(C)Oc2ccc(C#N)cc2[C@@H](N2CCCC2=O)[C@@H]1O | [C][C][Branch1][C][C][O][C][=C][C][=C][Branch1][Ring1][C][#N][C][=C][Ring1][Branch2][C@@H1][Branch1][=Branch2][N][C][C][C][C][Ring1][Branch1][=O][C@@H1][Ring2][Ring1][Ring1][O] | TVZCRIROJQEVOT-CABCVRRESA-N | (3S,4R)-3-hydroxy-2,2-dimethyl-4-(2-oxopyrrolidin-1-yl)-3,4-dihydrochromene-6-carbonitrile | Task: Please answer the multiple choice question.
Question: Which molecules are {toxicity_NR-Aromatase#not &NULL}{toxicity_NR-Aromatase__names__adjective}?
Constraint: You must select none, one or more options from {%multiple_choice_enum%2-5%aA1} without using any {#other|additional!} words.
Options:
{SMILES%toxicity_NR-Aromatase%}
Answer: {%multiple_choice_result} | Task: Please answer the multiple choice question.
Question: Which molecules are not toxic in the Aromatase enzyme assay?
Constraint: You must select none, one or more options from a, b, c, d, or e without using any additional words.
Options:
a: O=P1(N(CCCl)CCCl)NCCCO1
b: O=[N+]([O-])c1cccc(S(=O)(=O)NCCNS(=O)(=O)c2cccc([N+](=O)[O-])c2)c1
c: CC1(C)Oc2ccc(C#N)cc2[C@@H](N2CCCC2=O)[C@@H]1O
d: NC(=O)N=NC(N)=O
e: CCC1(C2=NCCN2)Cc2ccccc2O1
Answer: a, b, c, d, e |
|
TOX26856 | CC[C@H]1NC(=O)[C@@H](NC(=O)c2ncccc2O)C(C)OC(=O)[C@H](c2ccccc2)NC(=O)C2CC(=O)CCN2C(=O)[C@H](Cc2ccccc2)N(C)C(=O)[C@@H]2CCCN2C1=O | 0 | train | CC[C@H]1NC(=O)[C@@H](NC(=O)c2ncccc2O)C(C)OC(=O)[C@H](c2ccccc2)NC(=O)C2CC(=O)CCN2C(=O)[C@H](Cc2ccccc2)N(C)C(=O)[C@@H]2CCCN2C1=O | [C][C][C@H1][N][C][=Branch1][C][=O][C@@H1][Branch1][#C][N][C][=Branch1][C][=O][C][=N][C][=C][C][=C][Ring1][=Branch1][O][C][Branch1][C][C][O][C][=Branch1][C][=O][C@H1][Branch1][=Branch2][C][=C][C][=C][C][=C][Ring1][=Branch1][N][C][=Branch1][C][=O][C][C][C][=Branch1][C][=O][C][C][N][Ring1][#Branch1][C][=Branch1][C][=O][C@H1][Branch1][#Branch2][C][C][=C][C][=C][C][=C][Ring1][=Branch1][N][Branch1][C][C][C][=Branch1][C][=O][C@@H1][C][C][C][N][Ring1][Branch1][C][Ring2][Branch1][=Branch2][=O] | FEPMHVLSLDOMQC-ZVGMWUGDSA-N | N-[(3S,6S,12R,15S,19S)-3-benzyl-12-ethyl-4,16-dimethyl-2,5,11,14,18,21,24-heptaoxo-19-phenyl-17-oxa-1,4,10,13,20-pentazatricyclo[20.4.0.06,10]hexacosan-15-yl]-3-hydroxypyridine-2-carboxamide | Task: Please answer the multiple choice question.
Question: Which molecules are {toxicity_NR-Aromatase#not &NULL}{toxicity_NR-Aromatase__names__adjective}?
Constraint: You must select none, one or more options from {%multiple_choice_enum%2-5%aA1} without using any {#other|additional!} words.
Options:
{SMILES%toxicity_NR-Aromatase%}
Answer: {%multiple_choice_result} | Task: Please answer the multiple choice question.
Question: Which molecules are not toxic in the Aromatase enzyme assay?
Constraint: You must select none, one or more options from a, b, or c without using any additional words.
Options:
a CCCCCCCCNC
b CC[C@H]1NC(=O)[C@@H](NC(=O)c2ncccc2O)C(C)OC(=O)[C@H](c2ccccc2)NC(=O)C2CC(=O)CCN2C(=O)[C@H](Cc2ccccc2)N(C)C(=O)[C@@H]2CCCN2C1=O
c CC[C@@H](C)CCCCC(=O)N[C@H](CCN)C(=O)N[C@@H](C(=O)N[C@H](CCN)C(=O)N[C@@H]1CCNC(=O)C([C@@H](C)O)NC(=O)[C@@H](CCN)NC(=O)[C@@H](CCN)NC(=O)[C@@H](CC(C)C)NC(=O)[C@@H](Cc2ccccc2)NC(=O)[C@@H](CCN)NC1=O)[C@@H](C)O
Answer: a, b, c |
|
TOX22574 | CCN1CCCC1CNC(=O)c1cc(S(N)(=O)=O)ccc1OC | 0 | train | CCN1CCCC1CNC(=O)c1cc(S(N)(=O)=O)ccc1OC | [C][C][N][C][C][C][C][Ring1][Branch1][C][N][C][=Branch1][C][=O][C][=C][C][Branch1][=Branch2][S][Branch1][C][N][=Branch1][C][=O][=O][=C][C][=C][Ring1][#Branch2][O][C] | BGRJTUBHPOOWDU-UHFFFAOYSA-N | N-[(1-ethylpyrrolidin-2-yl)methyl]-2-methoxy-5-sulfamoylbenzamide | Task: Please answer the multiple choice question.
Question: Which molecules are {toxicity_NR-Aromatase#not &NULL}{toxicity_NR-Aromatase__names__adjective}?
Constraint: You must select none, one or more options from {%multiple_choice_enum%2-5%aA1} without using any {#other|additional!} words.
Options:
{SMILES%toxicity_NR-Aromatase%}
Answer: {%multiple_choice_result} | Task: Please answer the multiple choice question.
Question: Which molecules are not toxic in the NR-Aromatase enzyme assay?
Constraint: You must select none, one or more options from a, b, or c without using any other words.
Options:
a: CCN1CCCC1CNC(=O)c1cc(S(N)(=O)=O)ccc1OC
b: CC(C)CCCCCCCOC(=O)c1ccc(C(=O)OCCCCCCCC(C)C)c(C(=O)OCCCCCCCC(C)C)c1
c: Cc1ccc(C(C)NC(=O)[C@@H](NC(=O)OC(C)C)C(C)C)cc1
Answer: a, b, c |
|
TOX5849 | C=CCCC | 0 | train | C=CCCC | [C][=C][C][C][C] | YWAKXRMUMFPDSH-UHFFFAOYSA-N | pent-1-ene | Task: Please answer the multiple choice question.
Question: Which molecules are {toxicity_NR-Aromatase#not &NULL}{toxicity_NR-Aromatase__names__adjective}?
Constraint: You must select none, one or more options from {%multiple_choice_enum%2-5%aA1} without using any {#other|additional!} words.
Options:
{SMILES%toxicity_NR-Aromatase%}
Answer: {%multiple_choice_result} | Task: Please answer the multiple choice question.
Question: Which molecules are not toxic in the Aromatase enzyme assay?
Constraint: You must select none, one or more options from a, b, c, or d without using any additional words.
Options:
a. O=C([O-])P(=O)([O-])[O-]
b. Cc1ccccn1
c. C[Si](C)(CCCN)O[Si](C)(C)CCCN
d. C=CCCC
Answer: a, b, c, d |
|
TOX16435 | CCCCCCCCN1CCCC1=O | 0 | train | CCCCCCCCN1CCCC1=O | [C][C][C][C][C][C][C][C][N][C][C][C][C][Ring1][Branch1][=O] | WPPOGHDFAVQKLN-UHFFFAOYSA-N | 1-octylpyrrolidin-2-one | Task: Please answer the multiple choice question.
Question: Which molecules are {toxicity_NR-Aromatase#not &NULL}{toxicity_NR-Aromatase__names__adjective}?
Constraint: You must select none, one or more options from {%multiple_choice_enum%2-5%aA1} without using any {#other|additional!} words.
Options:
{SMILES%toxicity_NR-Aromatase%}
Answer: {%multiple_choice_result} | Task: Please answer the multiple choice question.
Question: Which molecules are not toxic in the NR-Aromatase enzyme assay?
Constraint: You must select none, one or more options from a, b, c, or d without using any additional words.
Options:
a. CCCCCCCCN1CCCC1=O
b. CC(=O)Nc1ccc(S(=O)(=O)Nc2ccc([N+](=O)[O-])cc2)cc1
c. O=S(=O)([O-])CC(O)CCl
d. CCC(Cl)C(Cl)C(Cl)CC(Cl)C(Cl)C(C)Cl
Answer: a, b, c, d |
|
TOX24852 | c1cc(CCCc2ccncc2)ccn1 | 1 | train | c1cc(CCCc2ccncc2)ccn1 | [C][=C][C][Branch1][N][C][C][C][C][=C][C][=N][C][=C][Ring1][=Branch1][=C][C][=N][Ring1][#C] | OGNCVVRIKNGJHQ-UHFFFAOYSA-N | 4-(3-pyridin-4-ylpropyl)pyridine | Task: Please answer the multiple choice question.
Question: Which molecules are {toxicity_NR-Aromatase#not &NULL}{toxicity_NR-Aromatase__names__adjective}?
Constraint: You must select none, one or more options from {%multiple_choice_enum%2-5%aA1} without using any {#other|additional!} words.
Options:
{SMILES%toxicity_NR-Aromatase%}
Answer: {%multiple_choice_result} | Task: Please answer the multiple choice question.
Question: Which molecules are toxic in the Aromatase enzyme assay?
Constraint: You must select none, one or more options from a, b, or c without using any additional words.
Options:
a. Nc1c(Br)cc(Br)c2c1C(=O)c1ccccc1C2=O
b. COc1ccc(C(=O)Nc2ccccc2CCC2CCCCN2C)cc1
c. c1cc(CCCc2ccncc2)ccn1
Answer: c |
|
TOX21436 | CCC(C)(C)O | 0 | train | CCC(C)(C)O | [C][C][C][Branch1][C][C][Branch1][C][C][O] | MSXVEPNJUHWQHW-UHFFFAOYSA-N | 2-methylbutan-2-ol | Task: Please answer the multiple choice question.
Question: Which molecules are {toxicity_NR-Aromatase#not &NULL}{toxicity_NR-Aromatase__names__adjective}?
Constraint: You must select none, one or more options from {%multiple_choice_enum%2-5%aA1} without using any {#other|additional!} words.
Options:
{SMILES%toxicity_NR-Aromatase%}
Answer: {%multiple_choice_result} | Task: Please answer the multiple choice question.
Question: Which molecules are not toxic in the NR-Aromatase enzyme assay?
Constraint: You must select none, one or more options from a, b, c, or d without using any additional words.
Options:
a.) CCC(C=O)CC
b.) CCC(C)(C)O
c.) CC#N
d.) COCC(C)N(C(=O)CCl)c1c(C)csc1C
Answer: a, b, c |
|
TOX4185 | COC(=O)Cl | 0 | train | COC(=O)Cl | [C][O][C][=Branch1][C][=O][Cl] | XMJHPCRAQCTCFT-UHFFFAOYSA-N | methylcarbonochloridate | Task: Please answer the multiple choice question.
Question: Which molecules are {toxicity_NR-Aromatase#not &NULL}{toxicity_NR-Aromatase__names__adjective}?
Constraint: You must select none, one or more options from {%multiple_choice_enum%2-5%aA1} without using any {#other|additional!} words.
Options:
{SMILES%toxicity_NR-Aromatase%}
Answer: {%multiple_choice_result} | Task: Please answer the multiple choice question.
Question: Which molecules are not toxic in the Aromatase enzyme assay?
Constraint: You must select none, one or more options from a or b without using any additional words.
Options:
a.) COC(=O)Cl
b.) CC(=O)Oc1cccc2c1C(=O)c1c(OC(C)=O)cc(C(=O)O)cc1C2=O
Answer: a, b |
|
TOX2603 | Nc1cc(-c2ccncc2)c[nH]c1=O | 0 | train | Nc1cc(-c2ccncc2)c[nH]c1=O | [N][C][=C][C][Branch1][=Branch2][C][=C][C][=N][C][=C][Ring1][=Branch1][=C][NH1][C][Ring1][N][=O] | RNLQIBCLLYYYFJ-UHFFFAOYSA-N | 3-amino-5-pyridin-4-yl-1H-pyridin-2-one | Task: Please answer the multiple choice question.
Question: Which molecules are {toxicity_NR-Aromatase#not &NULL}{toxicity_NR-Aromatase__names__adjective}?
Constraint: You must select none, one or more options from {%multiple_choice_enum%2-5%aA1} without using any {#other|additional!} words.
Options:
{SMILES%toxicity_NR-Aromatase%}
Answer: {%multiple_choice_result} | Task: Please answer the multiple choice question.
Question: Which molecules are not toxic in the NR-Aromatase enzyme assay?
Constraint: You must select none, one or more options from a or b without using any other words.
Options:
a: Nc1cc(-c2ccncc2)c[nH]c1=O
b: O=C1CN=C(c2ccccc2)c2cc(Cl)ccc2N1CC1CC1
Answer: a, b |
|
TOX3548 | CCC1NC(=O)c2cc(S(N)(=O)=O)c(Cl)cc2N1 | 0 | train | CCC1NC(=O)c2cc(S(N)(=O)=O)c(Cl)cc2N1 | [C][C][C][N][C][=Branch1][C][=O][C][=C][C][Branch1][=Branch2][S][Branch1][C][N][=Branch1][C][=O][=O][=C][Branch1][C][Cl][C][=C][Ring1][O][N][Ring1][S] | AGMMTXLNIQSRCG-UHFFFAOYSA-N | 7-chloro-2-ethyl-4-oxo-2,3-dihydro-1H-quinazoline-6-sulfonamide | Task: Please answer the multiple choice question.
Question: Which molecules are {toxicity_NR-Aromatase#not &NULL}{toxicity_NR-Aromatase__names__adjective}?
Constraint: You must select none, one or more options from {%multiple_choice_enum%2-5%aA1} without using any {#other|additional!} words.
Options:
{SMILES%toxicity_NR-Aromatase%}
Answer: {%multiple_choice_result} | Task: Please answer the multiple choice question.
Question: Which molecules are not toxic in the Aromatase enzyme assay?
Constraint: You must select none, one or more options from a, b, or c without using any additional words.
Options:
[a] CCC1NC(=O)c2cc(S(N)(=O)=O)c(Cl)cc2N1
[b] COC=O
[c] CC(C)(C#N)C(C)(C)C#N
Answer: a, b, c |
|
TOX8985 | CC(C)(c1ccccc1)c1cc(-n2nc3ccccc3n2)c(O)c(C(C)(C)c2ccccc2)c1 | 0 | train | CC(C)(c1ccccc1)c1cc(-n2nc3ccccc3n2)c(O)c(C(C)(C)c2ccccc2)c1 | [C][C][Branch1][C][C][Branch1][=Branch2][C][=C][C][=C][C][=C][Ring1][=Branch1][C][=C][C][Branch1][=C][N][N][=C][C][=C][C][=C][C][Ring1][=Branch1][=N][Ring1][=Branch2][=C][Branch1][C][O][C][Branch1][S][C][Branch1][C][C][Branch1][C][C][C][=C][C][=C][C][=C][Ring1][=Branch1][=C][Ring2][Ring1][=Branch2] | OLFNXLXEGXRUOI-UHFFFAOYSA-N | 2-(benzotriazol-2-yl)-4,6-bis(2-phenylpropan-2-yl)phenol | Task: Please answer the multiple choice question.
Question: Which molecules are {toxicity_NR-Aromatase#not &NULL}{toxicity_NR-Aromatase__names__adjective}?
Constraint: You must select none, one or more options from {%multiple_choice_enum%2-5%aA1} without using any {#other|additional!} words.
Options:
{SMILES%toxicity_NR-Aromatase%}
Answer: {%multiple_choice_result} | Task: Please answer the multiple choice question.
Question: Which molecules are not toxic in the NR-Aromatase enzyme assay?
Constraint: You must select none, one or more options from a, b, c, d, or e without using any other words.
Options:
a CCCSP(=O)(OCC)SCCC
b O=C1C=CC(=O)C=C1
c C=C/C(C)=C/C/C=C(\C)CCC=C(C)C
d OCCN(CCO)CCO
e CC(C)(c1ccccc1)c1cc(-n2nc3ccccc3n2)c(O)c(C(C)(C)c2ccccc2)c1
Answer: a, b, c, d, e |
|
TOX25321 | CC(CNC1CCCCC1)OC(=O)c1ccccc1 | 0 | train | CC(CNC1CCCCC1)OC(=O)c1ccccc1 | [C][C][Branch1][O][C][N][C][C][C][C][C][C][Ring1][=Branch1][O][C][=Branch1][C][=O][C][=C][C][=C][C][=C][Ring1][=Branch1] | DKLKMKYDWHYZTD-UHFFFAOYSA-N | 1-(cyclohexylamino)propan-2-yl benzoate | Task: Please answer the multiple choice question.
Question: Which molecules are {toxicity_NR-Aromatase#not &NULL}{toxicity_NR-Aromatase__names__adjective}?
Constraint: You must select none, one or more options from {%multiple_choice_enum%2-5%aA1} without using any {#other|additional!} words.
Options:
{SMILES%toxicity_NR-Aromatase%}
Answer: {%multiple_choice_result} | Task: Please answer the multiple choice question.
Question: Which molecules are not toxic in the NR-Aromatase enzyme assay?
Constraint: You must select none, one or more options from a, b, or c without using any other words.
Options:
[a] NC(=S)Nc1cccc2ccccc12
[b] CCCC[n+]1cccc(C)c1.F[B-](F)(F)F
[c] CC(CNC1CCCCC1)OC(=O)c1ccccc1
Answer: a, b, c |
|
TOX6461 | CC(C)C#N | 0 | train | CC(C)C#N | [C][C][Branch1][C][C][C][#N] | LRDFRRGEGBBSRN-UHFFFAOYSA-N | 2-methylpropanenitrile | Task: Please answer the multiple choice question.
Question: Which molecules are {toxicity_NR-Aromatase#not &NULL}{toxicity_NR-Aromatase__names__adjective}?
Constraint: You must select none, one or more options from {%multiple_choice_enum%2-5%aA1} without using any {#other|additional!} words.
Options:
{SMILES%toxicity_NR-Aromatase%}
Answer: {%multiple_choice_result} | Task: Please answer the multiple choice question.
Question: Which molecules are not toxic in the Aromatase enzyme assay?
Constraint: You must select none, one or more options from a, b, c, d, or e without using any additional words.
Options:
[a] CC1(C)S[C@@H]2[C@H](NC(=O)[C@@H](c3ccccc3)S(=O)(=O)[O-])C(=O)N2[C@H]1C(=O)[O-]
[b] O=CC(=O)c1ccccc1
[c] [I-].[K+]
[d] CC(C)C#N
[e] O=C(O)Cc1ccc(Cl)cc1Cl
Answer: a, b, c, d, e |
|
TOX1084 | COc1cc(/C=C/C(=O)O[C@H]2CC[C@]34C[C@]35CC[C@]3(C)[C@@H]([C@H](C)CCC=C(C)C)CC[C@@]3(C)[C@@H]5CC[C@H]4C2(C)C)ccc1O | 0 | train | COc1cc(/C=C/C(=O)O[C@H]2CC[C@]34C[C@]35CC[C@]3(C)[C@@H]([C@H](C)CCC=C(C)C)CC[C@@]3(C)[C@@H]5CC[C@H]4C2(C)C)ccc1O | [C][O][C][=C][C][Branch2][Branch1][#C][/C][=C][/C][=Branch1][C][=O][O][C@H1][C][C][C@][C][C@][Ring1][Ring1][C][C][C@][Branch1][C][C][C@@H1][Branch1][=N][C@H1][Branch1][C][C][C][C][C][=C][Branch1][C][C][C][C][C][C@@][Ring1][=C][Branch1][C][C][C@@H1][Ring2][Ring1][Ring1][C][C][C@H1][Ring2][Ring1][Branch2][C][Ring2][Ring1][N][Branch1][C][C][C][=C][C][=C][Ring2][Ring2][=Branch2][O] | FODTZLFLDFKIQH-FSVGXZBPSA-N | [(1S,3R,6S,8R,11S,12S,15R,16R)-7,7,12,16-tetramethyl-15-[(2R)-6-methylhept-5-en-2-yl]-6-pentacyclo[9.7.0.01,3.03,8.012,16]octadecanyl] (E)-3-(4-hydroxy-3-methoxyphenyl)prop-2-enoate | Task: Please answer the multiple choice question.
Question: Which molecules are {toxicity_NR-Aromatase#not &NULL}{toxicity_NR-Aromatase__names__adjective}?
Constraint: You must select none, one or more options from {%multiple_choice_enum%2-5%aA1} without using any {#other|additional!} words.
Options:
{SMILES%toxicity_NR-Aromatase%}
Answer: {%multiple_choice_result} | Task: Please answer the multiple choice question.
Question: Which molecules are not toxic in the NR-Aromatase enzyme assay?
Constraint: You must select none, one or more options from a, b, c, or d without using any other words.
Options:
[a] CC1CN1P(=O)(N1CC1C)N1CC1C
[b] CC1CCCC1
[c] CC(C)NC[C@@H](O)COc1ccc(CC(N)=O)cc1
[d] COc1cc(/C=C/C(=O)O[C@H]2CC[C@]34C[C@]35CC[C@]3(C)[C@@H]([C@H](C)CCC=C(C)C)CC[C@@]3(C)[C@@H]5CC[C@H]4C2(C)C)ccc1O
Answer: a, b, c, d |
|
TOX2676 | CC(C[N+](C)(C)C)OC(N)=O | 0 | train | CC(C[N+](C)(C)C)OC(N)=O | [C][C][Branch1][#Branch2][C][N+1][Branch1][C][C][Branch1][C][C][C][O][C][Branch1][C][N][=O] | NZUPCNDJBJXXRF-UHFFFAOYSA-O | 2-carbamoyloxypropyl(trimethyl)azanium | Task: Please answer the multiple choice question.
Question: Which molecules are {toxicity_NR-Aromatase#not &NULL}{toxicity_NR-Aromatase__names__adjective}?
Constraint: You must select none, one or more options from {%multiple_choice_enum%2-5%aA1} without using any {#other|additional!} words.
Options:
{SMILES%toxicity_NR-Aromatase%}
Answer: {%multiple_choice_result} | Task: Please answer the multiple choice question.
Question: Which molecules are not toxic in the NR-Aromatase enzyme assay?
Constraint: You must select none, one or more options from a or b without using any additional words.
Options:
[a] CCC1(C)CC(=O)NC1=O
[b] CC(C[N+](C)(C)C)OC(N)=O
Answer: a, b |
|
TOX26084 | C=CC1=C(C(=O)O)N2C(=O)[C@@H](NC(=O)/C(=N/O)c3csc(N)n3)[C@H]2SC1 | 0 | train | C=CC1=C(C(=O)O)N2C(=O)[C@@H](NC(=O)/C(=N/O)c3csc(N)n3)[C@H]2SC1 | [C][=C][C][=C][Branch1][=Branch1][C][=Branch1][C][=O][O][N][C][=Branch1][C][=O][C@@H1][Branch2][Ring1][Branch1][N][C][=Branch1][C][=O][/C][=Branch1][Ring1][=N][/O][C][=C][S][C][Branch1][C][N][=N][Ring1][=Branch1][C@H1][Ring1][P][S][C][Ring2][Ring1][Branch2] | RTXOFQZKPXMALH-RWFJUVPESA-N | (6R,7R)-7-[[(2E)-2-(2-amino-1,3-thiazol-4-yl)-2-hydroxyiminoacetyl]amino]-3-ethenyl-8-oxo-5-thia-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylic acid | Task: Please answer the multiple choice question.
Question: Which molecules are {toxicity_NR-Aromatase#not &NULL}{toxicity_NR-Aromatase__names__adjective}?
Constraint: You must select none, one or more options from {%multiple_choice_enum%2-5%aA1} without using any {#other|additional!} words.
Options:
{SMILES%toxicity_NR-Aromatase%}
Answer: {%multiple_choice_result} | Task: Please answer the multiple choice question.
Question: Which molecules are not toxic in the NR-Aromatase enzyme assay?
Constraint: You must select none, one or more options from a or b without using any additional words.
Options:
a. C=CC1=C(C(=O)O)N2C(=O)[C@@H](NC(=O)/C(=N/O)c3csc(N)n3)[C@H]2SC1
b. CC(=O)OCc1ccccc1
Answer: a, b |
|
TOX2977 | O=C(O)CN(CCN(CC(=O)O)CC(=O)O)CC(=O)O | 0 | train | O=C(O)CN(CCN(CC(=O)O)CC(=O)O)CC(=O)O | [O][=C][Branch1][C][O][C][N][Branch2][Ring1][C][C][C][N][Branch1][#Branch1][C][C][=Branch1][C][=O][O][C][C][=Branch1][C][=O][O][C][C][=Branch1][C][=O][O] | KCXVZYZYPLLWCC-UHFFFAOYSA-N | 2-[2-[bis(2-hydroxy-2-oxoethyl)amino]ethyl-(2-hydroxy-2-oxoethyl)amino]aceticacid | Task: Please answer the multiple choice question.
Question: Which molecules are {toxicity_NR-Aromatase#not &NULL}{toxicity_NR-Aromatase__names__adjective}?
Constraint: You must select none, one or more options from {%multiple_choice_enum%2-5%aA1} without using any {#other|additional!} words.
Options:
{SMILES%toxicity_NR-Aromatase%}
Answer: {%multiple_choice_result} | Task: Please answer the multiple choice question.
Question: Which molecules are not toxic in the Aromatase enzyme assay?
Constraint: You must select none, one or more options from a or b without using any additional words.
Options:
[a] O=C(O)CN(CCN(CC(=O)O)CC(=O)O)CC(=O)O
[b] O=C(O)CN(CCN(CC(=O)O)CC(=O)O)CC(=O)O
Answer: a, b |
|
TOX4437 | C=CCOC(C)=O | 0 | train | C=CCOC(C)=O | [C][=C][C][O][C][Branch1][C][C][=O] | FWZUNOYOVVKUNF-UHFFFAOYSA-N | prop-2-enyl acetate | Task: Please answer the multiple choice question.
Question: Which molecules are {toxicity_NR-Aromatase#not &NULL}{toxicity_NR-Aromatase__names__adjective}?
Constraint: You must select none, one or more options from {%multiple_choice_enum%2-5%aA1} without using any {#other|additional!} words.
Options:
{SMILES%toxicity_NR-Aromatase%}
Answer: {%multiple_choice_result} | Task: Please answer the multiple choice question.
Question: Which molecules are not toxic in the Aromatase enzyme assay?
Constraint: You must select none, one or more options from a, b, c, or d without using any additional words.
Options:
a: C=CCOC(C)=O
b: CC1(C)[C@H]2CC[C@](C)(C2)[C@H]1O
c: CC1CC(=O)NN=C1c1ccc(NCC(C)(C)NCC(O)COc2cc(Cl)ccc2C#N)cc1
d: COc1cc2nc(N3CCN(C(=O)C4COc5ccccc5O4)CC3)nc(N)c2cc1OC
Answer: a, b, c, d |
|
TOX4299 | C[C@H]1[C@H](c2ccc(Cl)cc2)SC(=O)N1C(=O)NC1CCCCC1 | 0 | train | C[C@H]1[C@H](c2ccc(Cl)cc2)SC(=O)N1C(=O)NC1CCCCC1 | [C][C@H1][C@H1][Branch1][N][C][=C][C][=C][Branch1][C][Cl][C][=C][Ring1][#Branch1][S][C][=Branch1][C][=O][N][Ring1][=N][C][=Branch1][C][=O][N][C][C][C][C][C][C][Ring1][=Branch1] | XGWIJUOSCAQSSV-XHDPSFHLSA-N | (4S,5S)-5-(4-chlorophenyl)-N-cyclohexyl-4-methyl-2-oxo-1,3-thiazolidine-3-carboxamide | Task: Please answer the multiple choice question.
Question: Which molecules are {toxicity_NR-Aromatase#not &NULL}{toxicity_NR-Aromatase__names__adjective}?
Constraint: You must select none, one or more options from {%multiple_choice_enum%2-5%aA1} without using any {#other|additional!} words.
Options:
{SMILES%toxicity_NR-Aromatase%}
Answer: {%multiple_choice_result} | Task: Please answer the multiple choice question.
Question: Which molecules are not toxic in the Aromatase enzyme assay?
Constraint: You must select none, one or more options from a, b, or c without using any additional words.
Options:
[a] C[C@H]1[C@H](c2ccc(Cl)cc2)SC(=O)N1C(=O)NC1CCCCC1
[b] COC1=CC=C2[C@H]3Cc4ccc(OC)c5c4[C@@]2(CCN3C)[C@H]1O5
[c] C#C[C@]1(O)CC[C@H]2[C@@H]3CCC4=CC(=O)CCC4=C3C=C[C@@]21CC
Answer: a, b, c |
|
TOX24842 | C[Si](NC1CCCCC1)(NC1CCCCC1)NC1CCCCC1 | 0 | train | C[Si](NC1CCCCC1)(NC1CCCCC1)NC1CCCCC1 | [C][Si][Branch1][#Branch2][N][C][C][C][C][C][C][Ring1][=Branch1][Branch1][#Branch2][N][C][C][C][C][C][C][Ring1][=Branch1][N][C][C][C][C][C][C][Ring1][=Branch1] | HDNXAGOHLKHJOA-UHFFFAOYSA-N | N-[bis(cyclohexylamino)-methylsilyl]cyclohexanamine | Task: Please answer the multiple choice question.
Question: Which molecules are {toxicity_NR-Aromatase#not &NULL}{toxicity_NR-Aromatase__names__adjective}?
Constraint: You must select none, one or more options from {%multiple_choice_enum%2-5%aA1} without using any {#other|additional!} words.
Options:
{SMILES%toxicity_NR-Aromatase%}
Answer: {%multiple_choice_result} | Task: Please answer the multiple choice question.
Question: Which molecules are not toxic in the Aromatase enzyme assay?
Constraint: You must select none, one or more options from a, b, c, d, or e without using any other words.
Options:
a) C[Si](NC1CCCCC1)(NC1CCCCC1)NC1CCCCC1
b) CCn1cc(C(=O)O)c(=O)c2cnc(N3CCNCC3)nc21
c) O=C1c2c(O)cccc2Cc2cccc(O)c21
d) Nc1ccccc1S(=O)(=O)O
e) CC(C)c1ccc2c(C(C)C)cc(C(C)C)c(S(=O)(=O)[O-])c2c1
Answer: a, b, c, d, e |
|
TOX7186 | CCOC(=O)Cl | 0 | train | CCOC(=O)Cl | [C][C][O][C][=Branch1][C][=O][Cl] | RIFGWPKJUGCATF-UHFFFAOYSA-N | ethylcarbonochloridate | Task: Please answer the multiple choice question.
Question: Which molecules are {toxicity_NR-Aromatase#not &NULL}{toxicity_NR-Aromatase__names__adjective}?
Constraint: You must select none, one or more options from {%multiple_choice_enum%2-5%aA1} without using any {#other|additional!} words.
Options:
{SMILES%toxicity_NR-Aromatase%}
Answer: {%multiple_choice_result} | Task: Please answer the multiple choice question.
Question: Which molecules are not toxic in the NR-Aromatase enzyme assay?
Constraint: You must select none, one or more options from a, b, c, d, or e without using any other words.
Options:
(a) CCCCON=O
(b) OCCC(F)(F)C(F)(F)C(F)(F)C(F)(F)C(F)(F)C(F)(F)F
(c) CCOC(=O)Cl
(d) O=NN(c1ccccc1)c1ccccc1
(e) CSC(C)(C)/C=N\O
Answer: a, b, c, d, e |
|
TOX5423 | NCCNCCO | 0 | train | NCCNCCO | [N][C][C][N][C][C][O] | LHIJANUOQQMGNT-UHFFFAOYSA-N | 2-(2-aminoethylamino)ethanol | Task: Please answer the multiple choice question.
Question: Which molecules are {toxicity_NR-Aromatase#not &NULL}{toxicity_NR-Aromatase__names__adjective}?
Constraint: You must select none, one or more options from {%multiple_choice_enum%2-5%aA1} without using any {#other|additional!} words.
Options:
{SMILES%toxicity_NR-Aromatase%}
Answer: {%multiple_choice_result} | Task: Please answer the multiple choice question.
Question: Which molecules are not toxic in the Aromatase enzyme assay?
Constraint: You must select none, one or more options from a or b without using any other words.
Options:
(a) NCCNCCO
(b) O=C(O)CCc1nc(-c2ccccc2)c(-c2ccccc2)o1
Answer: a, b |
|
TOX7309 | CCOCCC(=O)OCC | 0 | train | CCOCCC(=O)OCC | [C][C][O][C][C][C][=Branch1][C][=O][O][C][C] | BHXIWUJLHYHGSJ-UHFFFAOYSA-N | ethyl3-ethoxypropanoate | Task: Please answer the multiple choice question.
Question: Which molecules are {toxicity_NR-Aromatase#not &NULL}{toxicity_NR-Aromatase__names__adjective}?
Constraint: You must select none, one or more options from {%multiple_choice_enum%2-5%aA1} without using any {#other|additional!} words.
Options:
{SMILES%toxicity_NR-Aromatase%}
Answer: {%multiple_choice_result} | Task: Please answer the multiple choice question.
Question: Which molecules are not toxic in the NR-Aromatase enzyme assay?
Constraint: You must select none, one or more options from a, b, c, d, or e without using any other words.
Options:
a: CCOCCC(=O)OCC
b: CC(C)NCC(O)c1ccccc1Cl
c: CCCCN(CCCC)CCCOC(=O)c1ccc(N)cc1
d: CCc1cc(OC)c(C[C@H](C)N)cc1OC
e: COP(=S)(OC)Oc1nc(Cl)c(Cl)cc1Cl
Answer: a, b, c, d, e |
|
TOX7975 | C=C(C)C(=O)OCCCCCCCCCCCCCCCCCC | 0 | train | C=C(C)C(=O)OCCCCCCCCCCCCCCCCCC | [C][=C][Branch1][C][C][C][=Branch1][C][=O][O][C][C][C][C][C][C][C][C][C][C][C][C][C][C][C][C][C][C] | HMZGPNHSPWNGEP-UHFFFAOYSA-N | octadecyl 2-methylprop-2-enoate | Task: Please answer the multiple choice question.
Question: Which molecules are {toxicity_NR-Aromatase#not &NULL}{toxicity_NR-Aromatase__names__adjective}?
Constraint: You must select none, one or more options from {%multiple_choice_enum%2-5%aA1} without using any {#other|additional!} words.
Options:
{SMILES%toxicity_NR-Aromatase%}
Answer: {%multiple_choice_result} | Task: Please answer the multiple choice question.
Question: Which molecules are not toxic in the NR-Aromatase enzyme assay?
Constraint: You must select none, one or more options from a, b, or c without using any other words.
Options:
(a) C=C(C)C(=O)OCCCCCCCCCCCCCCCCCC
(b) O=[N+]([O-])c1ccc(O/N=C/c2cc(Br)c(O)c(Br)c2)c([N+](=O)[O-])c1
(c) C=CC(C)CCC=C(C)C
Answer: a, b, c |
|
TOX7857 | CC(C)C(=O)OCC(C)(C)C(O)C(C)C | 0 | train | CC(C)C(=O)OCC(C)(C)C(O)C(C)C | [C][C][Branch1][C][C][C][=Branch1][C][=O][O][C][C][Branch1][C][C][Branch1][C][C][C][Branch1][C][O][C][Branch1][C][C][C] | DAFHKNAQFPVRKR-UHFFFAOYSA-N | (3-hydroxy-2,2,4-trimethylpentyl)2-methylpropanoate | Task: Please answer the multiple choice question.
Question: Which molecules are {toxicity_NR-Aromatase#not &NULL}{toxicity_NR-Aromatase__names__adjective}?
Constraint: You must select none, one or more options from {%multiple_choice_enum%2-5%aA1} without using any {#other|additional!} words.
Options:
{SMILES%toxicity_NR-Aromatase%}
Answer: {%multiple_choice_result} | Task: Please answer the multiple choice question.
Question: Which molecules are not toxic in the NR-Aromatase enzyme assay?
Constraint: You must select none, one or more options from a or b without using any other words.
Options:
a) P#[In]
b) CC(C)C(=O)OCC(C)(C)C(O)C(C)C
Answer: a, b |
|
TOX27118 | Cc1occc1S | 0 | train | Cc1occc1S | [C][C][O][C][=C][C][=Ring1][Branch1][S] | RUYNUXHHUVUINQ-UHFFFAOYSA-N | 2-methylfuran-3-thiol | Task: Please answer the multiple choice question.
Question: Which molecules are {toxicity_NR-Aromatase#not &NULL}{toxicity_NR-Aromatase__names__adjective}?
Constraint: You must select none, one or more options from {%multiple_choice_enum%2-5%aA1} without using any {#other|additional!} words.
Options:
{SMILES%toxicity_NR-Aromatase%}
Answer: {%multiple_choice_result} | Task: Please answer the multiple choice question.
Question: Which molecules are not toxic in the Aromatase enzyme assay?
Constraint: You must select none, one or more options from a, b, c, or d without using any additional words.
Options:
[a] Cc1cc(C)n(CO)n1
[b] Cc1occc1S
[c] O=C1CC(=O)NC(=O)N1
[d] CC(C)(CO)[C@@H](O)C(=O)NCCC(=O)[O-]
Answer: a, b, c, d |
|
TOX28726 | CCN1C(=O)c2ccccc2C1Nc1ccc(OCCN2CCCCC2)cc1 | 0 | train | CCN1C(=O)c2ccccc2C1Nc1ccc(OCCN2CCCCC2)cc1 | [C][C][N][C][=Branch1][C][=O][C][=C][C][=C][C][=C][Ring1][=Branch1][C][Ring1][#Branch2][N][C][=C][C][=C][Branch1][N][O][C][C][N][C][C][C][C][C][Ring1][=Branch1][C][=C][Ring1][#C] | ITIONVBQFUNVJV-UHFFFAOYSA-N | 2-ethyl-3-[4-(2-piperidin-1-ylethoxy)anilino]-3H-isoindol-1-one | Task: Please answer the multiple choice question.
Question: Which molecules are {toxicity_NR-Aromatase#not &NULL}{toxicity_NR-Aromatase__names__adjective}?
Constraint: You must select none, one or more options from {%multiple_choice_enum%2-5%aA1} without using any {#other|additional!} words.
Options:
{SMILES%toxicity_NR-Aromatase%}
Answer: {%multiple_choice_result} | Task: Please answer the multiple choice question.
Question: Which molecules are not toxic in the Aromatase enzyme assay?
Constraint: You must select none, one or more options from a, b, c, d, or e without using any additional words.
Options:
a: CCN1C(=O)c2ccccc2C1Nc1ccc(OCCN2CCCCC2)cc1
b: CN(C)Cc1cc(C(C)(C)C)c(O)c(C(C)(C)C)c1
c: O=C(O)c1ccccc1C(=O)Nc1ccc(S(=O)(=O)Nc2nccs2)cc1
d: C1COCCO1
e: C/C=C/C=C/CO
Answer: a, b, c, d, e |
|
TOX15341 | CC1(C)C(=O)N(Br)C(=O)N1Br | 0 | train | CC1(C)C(=O)N(Br)C(=O)N1Br | [C][C][Branch1][C][C][C][=Branch1][C][=O][N][Branch1][C][Br][C][=Branch1][C][=O][N][Ring1][=Branch2][Br] | VRLDVERQJMEPIF-UHFFFAOYSA-N | 1,3-dibromo-5,5-dimethylimidazolidine-2,4-dione | Task: Please answer the multiple choice question.
Question: Which molecules are {toxicity_NR-Aromatase#not &NULL}{toxicity_NR-Aromatase__names__adjective}?
Constraint: You must select none, one or more options from {%multiple_choice_enum%2-5%aA1} without using any {#other|additional!} words.
Options:
{SMILES%toxicity_NR-Aromatase%}
Answer: {%multiple_choice_result} | Task: Please answer the multiple choice question.
Question: Which molecules are not toxic in the Aromatase enzyme assay?
Constraint: You must select none, one or more options from a, b, c, or d without using any other words.
Options:
a: COc1ccccc1N1CCN(CC(O)COc2cccc3ccccc23)CC1
b: CC(C)COC(=O)COc1ccc(Cl)cc1Cl
c: CC1(C)C(=O)N(Br)C(=O)N1Br
d: Cc1cccc(C)c1NC(=O)c1cc(S(N)(=O)=O)c(Cl)cc1O
Answer: a, b, c, d |
|
TOX27477 | C#CC1(O)CC[C@H]2[C@@H]3CCC4=CC(=O)CC[C@@H]4[C@H]3CC[C@@]21CC | 1 | train | C#CC1(O)CC[C@H]2[C@@H]3CCC4=CC(=O)CC[C@@H]4[C@H]3CC[C@@]21CC | [C][#C][C][Branch1][C][O][C][C][C@H1][C@@H1][C][C][C][=C][C][=Branch1][C][=O][C][C][C@@H1][Ring1][#Branch1][C@H1][Ring1][O][C][C][C@@][Ring1][#C][Ring2][Ring1][Ring1][C][C] | WWYNJERNGUHSAO-CULCCENASA-N | (8R,9S,10R,13S,14S)-13-ethyl-17-ethynyl-17-hydroxy-1,2,6,7,8,9,10,11,12,14,15,16-dodecahydrocyclopenta[a]phenanthren-3-one | Task: Please answer the multiple choice question.
Question: Which molecules are {toxicity_NR-Aromatase#not &NULL}{toxicity_NR-Aromatase__names__adjective}?
Constraint: You must select none, one or more options from {%multiple_choice_enum%2-5%aA1} without using any {#other|additional!} words.
Options:
{SMILES%toxicity_NR-Aromatase%}
Answer: {%multiple_choice_result} | Task: Please answer the multiple choice question.
Question: Which molecules are toxic in the NR-Aromatase enzyme assay?
Constraint: You must select none, one or more options from a or b without using any additional words.
Options:
a.) CC(C)=CC1C(C(=O)OCc2cccc(Oc3ccccc3)c2)C1(C)C
b.) C#CC1(O)CC[C@H]2[C@@H]3CCC4=CC(=O)CC[C@@H]4[C@H]3CC[C@@]21CC
Answer: b |
|
TOX3071 | CCN(CC)CCN1C(=O)CN=C(c2ccccc2F)c2cc(Cl)ccc21 | 0 | train | CCN(CC)CCN1C(=O)CN=C(c2ccccc2F)c2cc(Cl)ccc21 | [C][C][N][Branch1][Ring1][C][C][C][C][N][C][=Branch1][C][=O][C][N][=C][Branch1][#Branch2][C][=C][C][=C][C][=C][Ring1][=Branch1][F][C][=C][C][Branch1][C][Cl][=C][C][=C][Ring1][#Branch1][Ring2][Ring1][Ring2] | SAADBVWGJQAEFS-UHFFFAOYSA-N | 7-chloro-1-[2-(diethylamino)ethyl]-5-(2-fluorophenyl)-3H-1,4-benzodiazepin-2-one | Task: Please answer the multiple choice question.
Question: Which molecules are {toxicity_NR-Aromatase#not &NULL}{toxicity_NR-Aromatase__names__adjective}?
Constraint: You must select none, one or more options from {%multiple_choice_enum%2-5%aA1} without using any {#other|additional!} words.
Options:
{SMILES%toxicity_NR-Aromatase%}
Answer: {%multiple_choice_result} | Task: Please answer the multiple choice question.
Question: Which molecules are not toxic in the Aromatase enzyme assay?
Constraint: You must select none, one or more options from a or b without using any other words.
Options:
[a] CCCCCCC1CCCC(=O)O1
[b] CCN(CC)CCN1C(=O)CN=C(c2ccccc2F)c2cc(Cl)ccc21
Answer: a, b |
|
TOX4154 | CC(C)NC(=O)N1CC(=O)N(c2cc(Cl)cc(Cl)c2)C1=O | 0 | train | CC(C)NC(=O)N1CC(=O)N(c2cc(Cl)cc(Cl)c2)C1=O | [C][C][Branch1][C][C][N][C][=Branch1][C][=O][N][C][C][=Branch1][C][=O][N][Branch1][#C][C][=C][C][Branch1][C][Cl][=C][C][Branch1][C][Cl][=C][Ring1][Branch2][C][Ring1][=C][=O] | ONUFESLQCSAYKA-UHFFFAOYSA-N | 3-(3,5-dichlorocyclohexa-2,4,6-trien-1-yl)-2,4-dioxo-N-propan-2-ylimidazolidine-1-carboxamide | Task: Please answer the multiple choice question.
Question: Which molecules are {toxicity_NR-Aromatase#not &NULL}{toxicity_NR-Aromatase__names__adjective}?
Constraint: You must select none, one or more options from {%multiple_choice_enum%2-5%aA1} without using any {#other|additional!} words.
Options:
{SMILES%toxicity_NR-Aromatase%}
Answer: {%multiple_choice_result} | Task: Please answer the multiple choice question.
Question: Which molecules are not toxic in the Aromatase enzyme assay?
Constraint: You must select none, one or more options from a or b without using any other words.
Options:
a: COc1ccc(C(=O)CCC(=O)O)c2ccccc12
b: CC(C)NC(=O)N1CC(=O)N(c2cc(Cl)cc(Cl)c2)C1=O
Answer: a, b |
|
TOX12497 | O=C(O)COc1nc(Cl)c(Cl)cc1Cl | 0 | train | O=C(O)COc1nc(Cl)c(Cl)cc1Cl | [O][=C][Branch1][C][O][C][O][C][=N][C][Branch1][C][Cl][=C][Branch1][C][Cl][C][=C][Ring1][Branch2][Cl] | REEQLXCGVXDJSQ-UHFFFAOYSA-N | 2-(3,5,6-trichloropyridin-2-yl)oxyaceticacid | Task: Please answer the multiple choice question.
Question: Which molecules are {toxicity_NR-Aromatase#not &NULL}{toxicity_NR-Aromatase__names__adjective}?
Constraint: You must select none, one or more options from {%multiple_choice_enum%2-5%aA1} without using any {#other|additional!} words.
Options:
{SMILES%toxicity_NR-Aromatase%}
Answer: {%multiple_choice_result} | Task: Please answer the multiple choice question.
Question: Which molecules are not toxic in the NR-Aromatase enzyme assay?
Constraint: You must select none, one or more options from a, b, c, or d without using any additional words.
Options:
a. O=C(O)COc1nc(Cl)c(Cl)cc1Cl
b. NCCCN1CCN(CCCN)CC1
c. CCCCC(CC)COC(=O)c1ccccc1C(=O)OCC(CC)CCCC
d. Cn1c(=N)[nH]c2[nH]cnc2c1=O
Answer: a, b, c, d |
|
TOX1602 | CCCCCCCCCCCCCCCC(=O)O | 0 | train | CCCCCCCCCCCCCCCC(=O)O | [C][C][C][C][C][C][C][C][C][C][C][C][C][C][C][C][=Branch1][C][=O][O] | IPCSVZSSVZVIGE-UHFFFAOYSA-N | hexadecanoicacid | Task: Please answer the multiple choice question.
Question: Which molecules are {toxicity_NR-Aromatase#not &NULL}{toxicity_NR-Aromatase__names__adjective}?
Constraint: You must select none, one or more options from {%multiple_choice_enum%2-5%aA1} without using any {#other|additional!} words.
Options:
{SMILES%toxicity_NR-Aromatase%}
Answer: {%multiple_choice_result} | Task: Please answer the multiple choice question.
Question: Which molecules are not toxic in the NR-Aromatase enzyme assay?
Constraint: You must select none, one or more options from a or b without using any additional words.
Options:
a. CCOC(=O)Cc1cccc(-c2cc(CCCCCCc3ccc(O[C@H]4O[C@H](COC(C)=O)[C@@H](OC(C)=O)[C@H](OC(C)=O)[C@@H]4OC(C)=O)c(-c4cccc(CC(=O)OCC)c4)c3)ccc2O[C@H]2O[C@H](COC(C)=O)[C@@H](OC(C)=O)[C@H](OC(C)=O)[C@@H]2OC(C)=O)c1
b. CCCCCCCCCCCCCCCC(=O)O
Answer: a, b |
|
TOX4431 | CSC(C)(C)/C=N\O | 0 | train | CSC(C)(C)/C=N\O | [C][S][C][Branch1][C][C][Branch1][C][C][/C][=N][\O] | ZFGMCJAXIZTVJA-XQRVVYSFSA-N | (NZ)-N-(2-methyl-2-methylsulfanylpropylidene)hydroxylamine | Task: Please answer the multiple choice question.
Question: Which molecules are {toxicity_NR-Aromatase#not &NULL}{toxicity_NR-Aromatase__names__adjective}?
Constraint: You must select none, one or more options from {%multiple_choice_enum%2-5%aA1} without using any {#other|additional!} words.
Options:
{SMILES%toxicity_NR-Aromatase%}
Answer: {%multiple_choice_result} | Task: Please answer the multiple choice question.
Question: Which molecules are not toxic in the NR-Aromatase enzyme assay?
Constraint: You must select none, one or more options from a, b, c, d, or e without using any additional words.
Options:
a.) CC[C@@H](O)C(C[C@@H](C)N(C)C)(c1ccccc1)c1ccccc1
b.) C1=CCC=C1
c.) CSC(C)(C)/C=N\O
d.) O=C([O-])c1cc(=O)c2c(OCC(O)COc3cccc4oc(C(=O)[O-])cc(=O)c34)cccc2o1
e.) CNC(=O)Oc1cc(C)c(N(C)C)c(C)c1
Answer: a, b, c, d, e |
|
TOX5395 | C[Si](C)(C)N[Si](C)(C)C | 0 | train | C[Si](C)(C)N[Si](C)(C)C | [C][Si][Branch1][C][C][Branch1][C][C][N][Si][Branch1][C][C][Branch1][C][C][C] | FFUAGWLWBBFQJT-UHFFFAOYSA-N | [dimethyl-(trimethylsilylamino)silyl]methane | Task: Please answer the multiple choice question.
Question: Which molecules are {toxicity_NR-Aromatase#not &NULL}{toxicity_NR-Aromatase__names__adjective}?
Constraint: You must select none, one or more options from {%multiple_choice_enum%2-5%aA1} without using any {#other|additional!} words.
Options:
{SMILES%toxicity_NR-Aromatase%}
Answer: {%multiple_choice_result} | Task: Please answer the multiple choice question.
Question: Which molecules are not toxic in the Aromatase enzyme assay?
Constraint: You must select none, one or more options from a or b without using any additional words.
Options:
a) CCCCCCCCCCCC(C)=O
b) C[Si](C)(C)N[Si](C)(C)C
Answer: a, b |
|
TOX1631 | Cc1cc(N)no1 | 0 | train | Cc1cc(N)no1 | [C][C][=C][C][Branch1][C][N][=N][O][Ring1][=Branch1] | FKPXGNGUVSHWQQ-UHFFFAOYSA-N | 5-methyl-1,2-oxazol-3-amine | Task: Please answer the multiple choice question.
Question: Which molecules are {toxicity_NR-Aromatase#not &NULL}{toxicity_NR-Aromatase__names__adjective}?
Constraint: You must select none, one or more options from {%multiple_choice_enum%2-5%aA1} without using any {#other|additional!} words.
Options:
{SMILES%toxicity_NR-Aromatase%}
Answer: {%multiple_choice_result} | Task: Please answer the multiple choice question.
Question: Which molecules are not toxic in the Aromatase enzyme assay?
Constraint: You must select none, one or more options from a or b without using any other words.
Options:
a. Cc1ccnc(NS(=O)(=O)c2ccc(N)cc2)n1
b. Cc1cc(N)no1
Answer: a, b |
|
TOX24252 | CC(C)CCCC(=O)O | 0 | train | CC(C)CCCC(=O)O | [C][C][Branch1][C][C][C][C][C][C][=Branch1][C][=O][O] | MHPUGCYGQWGLJL-UHFFFAOYSA-N | 5-methylhexanoic acid | Task: Please answer the multiple choice question.
Question: Which molecules are {toxicity_NR-Aromatase#not &NULL}{toxicity_NR-Aromatase__names__adjective}?
Constraint: You must select none, one or more options from {%multiple_choice_enum%2-5%aA1} without using any {#other|additional!} words.
Options:
{SMILES%toxicity_NR-Aromatase%}
Answer: {%multiple_choice_result} | Task: Please answer the multiple choice question.
Question: Which molecules are not toxic in the NR-Aromatase enzyme assay?
Constraint: You must select none, one or more options from a, b, c, d, or e without using any other words.
Options:
a: COc1ccc(Cl)cc1C
b: Clc1ccc([C@@H]2C[C@H]3CC[C@@H]2N3)cn1
c: CCCc1ccc(O)c(OC)c1
d: CC(C)CCCC(=O)O
e: CC[C@H](C)[C@H]1O[C@]2(C=C[C@@H]1C)C[C@@H]1C[C@@H](CC=C(C)[C@@H](O[C@H]3C[C@H](OC)[C@@H](O[C@H]4C[C@H](OC)[C@@H](O)[C@H](C)O4)[C@H](C)O3)[C@@H](C)C=CC=C3CO[C@@H]4[C@H](O)C(C)=C[C@@H](C(=O)O1)[C@]34O)O2
Answer: a, b, c, d, e |
|
TOX14089 | CC1=C2[C@H](/C=C(\C)C(=O)O)CC[C@@H](C)[C@H]2CC1 | 0 | train | CC1=C2[C@H](/C=C(\C)C(=O)O)CC[C@@H](C)[C@H]2CC1 | [C][C][=C][C@H1][Branch1][O][/C][=C][Branch1][C][\C][C][=Branch1][C][=O][O][C][C][C@@H1][Branch1][C][C][C@H1][Ring1][=N][C][C][Ring1][S] | FEBNTWHYQKGEIQ-SUKRRCERSA-N | (E)-3-[(4S,7R,7aR)-3,7-dimethyl-2,4,5,6,7,7a-hexahydro-1H-inden-4-yl]-2-methylprop-2-enoic acid | Task: Please answer the multiple choice question.
Question: Which molecules are {toxicity_NR-Aromatase#not &NULL}{toxicity_NR-Aromatase__names__adjective}?
Constraint: You must select none, one or more options from {%multiple_choice_enum%2-5%aA1} without using any {#other|additional!} words.
Options:
{SMILES%toxicity_NR-Aromatase%}
Answer: {%multiple_choice_result} | Task: Please answer the multiple choice question.
Question: Which molecules are not toxic in the Aromatase enzyme assay?
Constraint: You must select none, one or more options from a, b, c, or d without using any additional words.
Options:
a.) CCOP(=S)(OCC)Oc1cc(-c2ccccc2)on1
b.) CCCCCCCCc1ccc(S(=O)(=O)[O-])cc1
c.) CCC[Si](OC)(OC)OC
d.) CC1=C2[C@H](/C=C(\C)C(=O)O)CC[C@@H](C)[C@H]2CC1
Answer: a, b, c, d |
|
TOX25888 | CC(=O)NC1CCSC1=O | 0 | train | CC(=O)NC1CCSC1=O | [C][C][=Branch1][C][=O][N][C][C][C][S][C][Ring1][Branch1][=O] | NRFJZTXWLKPZAV-UHFFFAOYSA-N | N-(2-oxothiolan-3-yl)acetamide | Task: Please answer the multiple choice question.
Question: Which molecules are {toxicity_NR-Aromatase#not &NULL}{toxicity_NR-Aromatase__names__adjective}?
Constraint: You must select none, one or more options from {%multiple_choice_enum%2-5%aA1} without using any {#other|additional!} words.
Options:
{SMILES%toxicity_NR-Aromatase%}
Answer: {%multiple_choice_result} | Task: Please answer the multiple choice question.
Question: Which molecules are not toxic in the NR-Aromatase enzyme assay?
Constraint: You must select none, one or more options from a, b, c, or d without using any additional words.
Options:
a. CC(=O)NC1CCSC1=O
b. CCCCCCC1CCOC1=O
c. O=C(OCCCCCOC(=O)c1ccccc1)c1ccccc1
d. CCOCC(C)O
Answer: a, b, c, d |
|
TOX24884 | C=CC(=O)OCC1CCCO1 | 0 | train | C=CC(=O)OCC1CCCO1 | [C][=C][C][=Branch1][C][=O][O][C][C][C][C][C][O][Ring1][Branch1] | YNXCGLKMOXLBOD-UHFFFAOYSA-N | oxolan-2-ylmethyl prop-2-enoate | Task: Please answer the multiple choice question.
Question: Which molecules are {toxicity_NR-Aromatase#not &NULL}{toxicity_NR-Aromatase__names__adjective}?
Constraint: You must select none, one or more options from {%multiple_choice_enum%2-5%aA1} without using any {#other|additional!} words.
Options:
{SMILES%toxicity_NR-Aromatase%}
Answer: {%multiple_choice_result} | Task: Please answer the multiple choice question.
Question: Which molecules are not toxic in the Aromatase enzyme assay?
Constraint: You must select none, one or more options from a, b, or c without using any additional words.
Options:
a. C=CC(=O)OCC1CCCO1
b. Cc1ccccc1C(=O)Nc1cccc(OC(C)C)c1
c. NCCNCCNCCNCCN
Answer: a, b, c |
|
TOX5111 | CCC(C)(C)C | 0 | train | CCC(C)(C)C | [C][C][C][Branch1][C][C][Branch1][C][C][C] | HNRMPXKDFBEGFZ-UHFFFAOYSA-N | 2,2-dimethylbutane | Task: Please answer the multiple choice question.
Question: Which molecules are {toxicity_NR-Aromatase#not &NULL}{toxicity_NR-Aromatase__names__adjective}?
Constraint: You must select none, one or more options from {%multiple_choice_enum%2-5%aA1} without using any {#other|additional!} words.
Options:
{SMILES%toxicity_NR-Aromatase%}
Answer: {%multiple_choice_result} | Task: Please answer the multiple choice question.
Question: Which molecules are not toxic in the NR-Aromatase enzyme assay?
Constraint: You must select none, one or more options from a or b without using any other words.
Options:
a) CCN(CC)C(=O)[C@@H]1C=C2c3cccc4[nH]cc(c34)C[C@H]2N(C)C1
b) CCC(C)(C)C
Answer: a, b |
|
TOX1087 | O=C1Nc2ccc(Cl)cc2C(c2ccccc2)=NC1O | 0 | train | O=C1Nc2ccc(Cl)cc2C(c2ccccc2)=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][=N][C][Ring2][Ring1][C][O] | ADIMAYPTOBDMTL-UHFFFAOYSA-N | 7-chloro-3-hydroxy-5-phenyl-1,3-dihydro-1,4-benzodiazepin-2-one | Task: Please answer the multiple choice question.
Question: Which molecules are {toxicity_NR-Aromatase#not &NULL}{toxicity_NR-Aromatase__names__adjective}?
Constraint: You must select none, one or more options from {%multiple_choice_enum%2-5%aA1} without using any {#other|additional!} words.
Options:
{SMILES%toxicity_NR-Aromatase%}
Answer: {%multiple_choice_result} | Task: Please answer the multiple choice question.
Question: Which molecules are not toxic in the Aromatase enzyme assay?
Constraint: You must select none, one or more options from a or b without using any additional words.
Options:
a O=C1Nc2ccc(Cl)cc2C(c2ccccc2)=NC1O
b CC12CCC(C1)C(C)(C)C2O
Answer: a, b |
|
TOX6915 | CCCCCCCCCCCO | 0 | train | CCCCCCCCCCCO | [C][C][C][C][C][C][C][C][C][C][C][O] | KJIOQYGWTQBHNH-UHFFFAOYSA-N | undecan-1-ol | Task: Please answer the multiple choice question.
Question: Which molecules are {toxicity_NR-Aromatase#not &NULL}{toxicity_NR-Aromatase__names__adjective}?
Constraint: You must select none, one or more options from {%multiple_choice_enum%2-5%aA1} without using any {#other|additional!} words.
Options:
{SMILES%toxicity_NR-Aromatase%}
Answer: {%multiple_choice_result} | Task: Please answer the multiple choice question.
Question: Which molecules are not toxic in the NR-Aromatase enzyme assay?
Constraint: You must select none, one or more options from a, b, or c without using any additional words.
Options:
a) CCCCCCCCCCCO
b) Clc1cc(Cl)cc(Cl)c1
c) CCCC1COC(Cn2cncn2)(c2ccc(Cl)cc2Cl)O1
Answer: a, b |
|
TOX3179 | COC(=O)C1=C(C)NC(C)=C(C(=O)OC(C)C)C1c1cccc2nonc12 | 0 | train | COC(=O)C1=C(C)NC(C)=C(C(=O)OC(C)C)C1c1cccc2nonc12 | [C][O][C][=Branch1][C][=O][C][=C][Branch1][C][C][N][C][Branch1][C][C][=C][Branch1][O][C][=Branch1][C][=O][O][C][Branch1][C][C][C][C][Ring1][=C][C][=C][C][=C][C][=N][O][N][=C][Ring1][=Branch2][Ring1][Branch1] | HMJIYCCIJYRONP-UHFFFAOYSA-N | 3-O-methyl 5-O-propan-2-yl 4-(2,1,3-benzoxadiazol-4-yl)-2,6-dimethyl-1,4-dihydropyridine-3,5-dicarboxylate | Task: Please answer the multiple choice question.
Question: Which molecules are {toxicity_NR-Aromatase#not &NULL}{toxicity_NR-Aromatase__names__adjective}?
Constraint: You must select none, one or more options from {%multiple_choice_enum%2-5%aA1} without using any {#other|additional!} words.
Options:
{SMILES%toxicity_NR-Aromatase%}
Answer: {%multiple_choice_result} | Task: Please answer the multiple choice question.
Question: Which molecules are not toxic in the NR-Aromatase enzyme assay?
Constraint: You must select none, one or more options from a or b without using any other words.
Options:
a. COc1ccc2c(c1)C(=O)N(CCc1ccc(S(=O)(=O)NC(=O)NC3CCCCC3)cc1)C(=O)C2(C)C
b. COC(=O)C1=C(C)NC(C)=C(C(=O)OC(C)C)C1c1cccc2nonc12
Answer: a, b |
|
TOX29268 | Brc1c2ccccc2c(Br)c2ccccc12 | 0 | train | Brc1c2ccccc2c(Br)c2ccccc12 | [Br][C][=C][C][=C][C][=C][C][Ring1][=Branch1][=C][Branch1][C][Br][C][=C][C][=C][C][=C][Ring1][#C][Ring1][=Branch1] | BRUOAURMAFDGLP-UHFFFAOYSA-N | 9,10-dibromoanthracene | Task: Please answer the multiple choice question.
Question: Which molecules are {toxicity_NR-Aromatase#not &NULL}{toxicity_NR-Aromatase__names__adjective}?
Constraint: You must select none, one or more options from {%multiple_choice_enum%2-5%aA1} without using any {#other|additional!} words.
Options:
{SMILES%toxicity_NR-Aromatase%}
Answer: {%multiple_choice_result} | Task: Please answer the multiple choice question.
Question: Which molecules are not toxic in the Aromatase enzyme assay?
Constraint: You must select none, one or more options from a, b, c, d, or e without using any additional words.
Options:
a) Brc1c2ccccc2c(Br)c2ccccc12
b) CN(C)N=O
c) CC(C)(C)c1ccccc1O
d) CC(C)(C)OC=O
e) CCCCOC(O)CC
Answer: a, b, c, d, e |
|
TOX468 | O=CNNC=O | 0 | train | O=CNNC=O | [O][=C][N][N][C][=O] | POVXOWVFLAAVBH-UHFFFAOYSA-N | N-formamidoformamide | Task: Please answer the multiple choice question.
Question: Which molecules are {toxicity_NR-Aromatase#not &NULL}{toxicity_NR-Aromatase__names__adjective}?
Constraint: You must select none, one or more options from {%multiple_choice_enum%2-5%aA1} without using any {#other|additional!} words.
Options:
{SMILES%toxicity_NR-Aromatase%}
Answer: {%multiple_choice_result} | Task: Please answer the multiple choice question.
Question: Which molecules are not toxic in the Aromatase enzyme assay?
Constraint: You must select none, one or more options from a, b, c, or d without using any additional words.
Options:
a O=C1CCc2ccccc2O1
b O=CNNC=O
c COC(C)CCO
d CCCCCCCCCCCCCCCS(=O)(=O)Oc1ccccc1
Answer: a, b, c, d |
|
TOX1886 | CC(C)(C)CC(C)(C)N | 0 | train | CC(C)(C)CC(C)(C)N | [C][C][Branch1][C][C][Branch1][C][C][C][C][Branch1][C][C][Branch1][C][C][N] | QIJIUJYANDSEKG-UHFFFAOYSA-N | 2,4,4-trimethylpentan-2-amine | Task: Please answer the multiple choice question.
Question: Which molecules are {toxicity_NR-Aromatase#not &NULL}{toxicity_NR-Aromatase__names__adjective}?
Constraint: You must select none, one or more options from {%multiple_choice_enum%2-5%aA1} without using any {#other|additional!} words.
Options:
{SMILES%toxicity_NR-Aromatase%}
Answer: {%multiple_choice_result} | Task: Please answer the multiple choice question.
Question: Which molecules are not toxic in the NR-Aromatase enzyme assay?
Constraint: You must select none, one or more options from a, b, or c without using any other words.
Options:
a.) CC(C)(C)CC(C)(C)N
b.) O=C(O)c1ccccc1C(c1ccc(O)cc1)c1ccc(O)cc1
c.) ClCc1ccccn1
Answer: a, b, c |
|
TOX6694 | CCCCC(CC)COC(C)=O | 0 | train | CCCCC(CC)COC(C)=O | [C][C][C][C][C][Branch1][Ring1][C][C][C][O][C][Branch1][C][C][=O] | WOYWLLHHWAMFCB-UHFFFAOYSA-N | 2-ethylhexylacetate | Task: Please answer the multiple choice question.
Question: Which molecules are {toxicity_NR-Aromatase#not &NULL}{toxicity_NR-Aromatase__names__adjective}?
Constraint: You must select none, one or more options from {%multiple_choice_enum%2-5%aA1} without using any {#other|additional!} words.
Options:
{SMILES%toxicity_NR-Aromatase%}
Answer: {%multiple_choice_result} | Task: Please answer the multiple choice question.
Question: Which molecules are not toxic in the Aromatase enzyme assay?
Constraint: You must select none, one or more options from a or b without using any additional words.
Options:
a) CNC(=O)N(c1ccccc1)c1ccccc1
b) CCCCC(CC)COC(C)=O
Answer: a, b |
|
TOX25865 | CC(=O)Nc1ccc(OC(=O)c2ccccc2O)cc1 | 0 | train | CC(=O)Nc1ccc(OC(=O)c2ccccc2O)cc1 | [C][C][=Branch1][C][=O][N][C][=C][C][=C][Branch1][#C][O][C][=Branch1][C][=O][C][=C][C][=C][C][=C][Ring1][=Branch1][O][C][=C][Ring1][S] | TWIIVLKQFJBFPW-UHFFFAOYSA-N | (4-acetamidocyclohexa-1,3,5-trien-1-yl)6-hydroxycyclohexa-1,3,5-triene-1-carboxylate | Task: Please answer the multiple choice question.
Question: Which molecules are {toxicity_NR-Aromatase#not &NULL}{toxicity_NR-Aromatase__names__adjective}?
Constraint: You must select none, one or more options from {%multiple_choice_enum%2-5%aA1} without using any {#other|additional!} words.
Options:
{SMILES%toxicity_NR-Aromatase%}
Answer: {%multiple_choice_result} | Task: Please answer the multiple choice question.
Question: Which molecules are not toxic in the NR-Aromatase enzyme assay?
Constraint: You must select none, one or more options from a, b, or c without using any additional words.
Options:
a. COc1ccc2cc([C@H](C)C(=O)[O-])ccc2c1
b. Cc1ccc(S(=O)(=O)O)cc1
c. CC(=O)Nc1ccc(OC(=O)c2ccccc2O)cc1
Answer: a, b, c |
|
TOX1638 | CC(Cl)(Cl)[N+](=O)[O-] | 0 | train | CC(Cl)(Cl)[N+](=O)[O-] | [C][C][Branch1][C][Cl][Branch1][C][Cl][N+1][=Branch1][C][=O][O-1] | OQOGEOLRYAOSKO-UHFFFAOYSA-N | 1,1-dichloro-1-nitroethane | Task: Please answer the multiple choice question.
Question: Which molecules are {toxicity_NR-Aromatase#not &NULL}{toxicity_NR-Aromatase__names__adjective}?
Constraint: You must select none, one or more options from {%multiple_choice_enum%2-5%aA1} without using any {#other|additional!} words.
Options:
{SMILES%toxicity_NR-Aromatase%}
Answer: {%multiple_choice_result} | Task: Please answer the multiple choice question.
Question: Which molecules are not toxic in the NR-Aromatase enzyme assay?
Constraint: You must select none, one or more options from a, b, c, or d without using any additional words.
Options:
a: CCC(C)(C)OC
b: CCCOC(=O)c1c(Cl)c(Cl)c(Cl)c(Cl)c1C(=O)OCCC
c: CC(=O)O[C@H]1C[C@@]2(C)[C@@H](C[C@@H](O)[C@H]3[C@@]4(C)CC[C@@H](O)[C@@H](C)[C@@H]4CC[C@@]32C)/C1=C(\CCC=C(C)C)C(=O)[O-]
d: CC(Cl)(Cl)[N+](=O)[O-]
Answer: a, b, c, d |
|
TOX21728 | CCOc1ccc(N=Nc2ccc(C=Cc3ccc(N=Nc4ccc(OCC)cc4)cc3S(=O)(=O)[O-])c(S(=O)(=O)[O-])c2)cc1 | 0 | train | CCOc1ccc(N=Nc2ccc(C=Cc3ccc(N=Nc4ccc(OCC)cc4)cc3S(=O)(=O)[O-])c(S(=O)(=O)[O-])c2)cc1 | [C][C][O][C][=C][C][=C][Branch2][Branch1][N][N][=N][C][=C][C][=C][Branch2][Ring2][Ring2][C][=C][C][=C][C][=C][Branch1][S][N][=N][C][=C][C][=C][Branch1][Ring2][O][C][C][C][=C][Ring1][=Branch2][C][=C][Ring1][P][S][=Branch1][C][=O][=Branch1][C][=O][O-1][C][Branch1][=Branch2][S][=Branch1][C][=O][=Branch1][C][=O][O-1][=C][Ring2][Ring1][P][C][=C][Ring2][Ring2][=Branch2] | AVERNFJXXRIVQN-UHFFFAOYSA-L | 5-[(4-ethoxyphenyl)diazenyl]-2-[2-[4-[(4-ethoxyphenyl)diazenyl]-2-sulfonatophenyl]ethenyl]benzenesulfonate | Task: Please answer the multiple choice question.
Question: Which molecules are {toxicity_NR-Aromatase#not &NULL}{toxicity_NR-Aromatase__names__adjective}?
Constraint: You must select none, one or more options from {%multiple_choice_enum%2-5%aA1} without using any {#other|additional!} words.
Options:
{SMILES%toxicity_NR-Aromatase%}
Answer: {%multiple_choice_result} | Task: Please answer the multiple choice question.
Question: Which molecules are not toxic in the NR-Aromatase enzyme assay?
Constraint: You must select none, one or more options from a, b, c, or d without using any additional words.
Options:
a: Cc1c2ccccc2c(C)c2c1ccc1ccccc12
b: CCCCCCCC(=O)OCCCCCC
c: CCOc1ccc(N=Nc2ccc(C=Cc3ccc(N=Nc4ccc(OCC)cc4)cc3S(=O)(=O)[O-])c(S(=O)(=O)[O-])c2)cc1
d: C1C2OC2C2C1C1CC2C2OC12
Answer: b, c, d |
|
TOX22053 | O=C(O)C(=O)Cc1c[nH]c2ccccc12 | 0 | train | O=C(O)C(=O)Cc1c[nH]c2ccccc12 | [O][=C][Branch1][C][O][C][=Branch1][C][=O][C][C][=C][NH1][C][=C][C][=C][C][=C][Ring1][=Branch2][Ring1][=Branch1] | RSTKLPZEZYGQPY-UHFFFAOYSA-N | 3-(1H-indol-3-yl)-2-oxopropanoicacid | Task: Please answer the multiple choice question.
Question: Which molecules are {toxicity_NR-Aromatase#not &NULL}{toxicity_NR-Aromatase__names__adjective}?
Constraint: You must select none, one or more options from {%multiple_choice_enum%2-5%aA1} without using any {#other|additional!} words.
Options:
{SMILES%toxicity_NR-Aromatase%}
Answer: {%multiple_choice_result} | Task: Please answer the multiple choice question.
Question: Which molecules are not toxic in the Aromatase enzyme assay?
Constraint: You must select none, one or more options from a, b, c, d, or e without using any additional words.
Options:
(a) O=C(O)C(=O)Cc1c[nH]c2ccccc12
(b) CC(C)(c1cc(Cl)c(O)c(Cl)c1)c1cc(Cl)c(O)c(Cl)c1
(c) C/C=C(\C)C(=O)OCC/C=C\CC
(d) CCCCCCCCC
(e) C=C(C)C(=O)OCC(C)O
Answer: a, b, c, d, e |
|
TOX14929 | Cc1cc(C)c(C2=C(OC(=O)CC(C)(C)C)C3(CCCC3)OC2=O)c(C)c1 | 0 | train | Cc1cc(C)c(C2=C(OC(=O)CC(C)(C)C)C3(CCCC3)OC2=O)c(C)c1 | [C][C][=C][C][Branch1][C][C][=C][Branch2][Ring1][P][C][=C][Branch1][#C][O][C][=Branch1][C][=O][C][C][Branch1][C][C][Branch1][C][C][C][C][Branch1][#Branch1][C][C][C][C][Ring1][Branch1][O][C][Ring1][P][=O][C][Branch1][C][C][=C][Ring2][Ring1][#Branch2] | GOLXNESZZPUPJE-UHFFFAOYSA-N | [2-oxo-3-(2,4,6-trimethylphenyl)-1-oxaspiro[4.4]non-3-en-4-yl] 3,3-dimethylbutanoate | Task: Please answer the multiple choice question.
Question: Which molecules are {toxicity_NR-Aromatase#not &NULL}{toxicity_NR-Aromatase__names__adjective}?
Constraint: You must select none, one or more options from {%multiple_choice_enum%2-5%aA1} without using any {#other|additional!} words.
Options:
{SMILES%toxicity_NR-Aromatase%}
Answer: {%multiple_choice_result} | Task: Please answer the multiple choice question.
Question: Which molecules are not toxic in the Aromatase enzyme assay?
Constraint: You must select none, one or more options from a, b, or c without using any other words.
Options:
a) N#Cc1c(F)cccc1F
b) Nc1ccc(S(=O)(=O)c2ccc(N)cc2)cc1
c) Cc1cc(C)c(C2=C(OC(=O)CC(C)(C)C)C3(CCCC3)OC2=O)c(C)c1
Answer: a, b, c |
|
TOX2194 | C=CC(=O)OCCCCCC | 0 | train | C=CC(=O)OCCCCCC | [C][=C][C][=Branch1][C][=O][O][C][C][C][C][C][C] | LNMQRPPRQDGUDR-UHFFFAOYSA-N | hexylprop-2-enoate | Task: Please answer the multiple choice question.
Question: Which molecules are {toxicity_NR-Aromatase#not &NULL}{toxicity_NR-Aromatase__names__adjective}?
Constraint: You must select none, one or more options from {%multiple_choice_enum%2-5%aA1} without using any {#other|additional!} words.
Options:
{SMILES%toxicity_NR-Aromatase%}
Answer: {%multiple_choice_result} | Task: Please answer the multiple choice question.
Question: Which molecules are not toxic in the NR-Aromatase enzyme assay?
Constraint: You must select none, one or more options from a, b, or c without using any other words.
Options:
[a] Cc1nn(-c2cc(NS(C)(=O)=O)c(Cl)cc2Cl)c(=O)n1C(F)F
[b] C=CC(=O)OCCCCCC
[c] CCOC(=O)Nc1ccc2c(c1)N(C(=O)CN(C)C)c1ccccc1CC2
Answer: a, b, c |
|
TOX29333 | C[C@H]1[C@@H](c2ccccc2)N=C(O)N1C | 0 | train | C[C@H]1[C@@H](c2ccccc2)N=C(O)N1C | [C][C@H1][C@@H1][Branch1][=Branch2][C][=C][C][=C][C][=C][Ring1][=Branch1][N][=C][Branch1][C][O][N][Ring1][N][C] | BGPAZBKCZVVZGF-WPRPVWTQSA-N | (4R,5S)-1,5-dimethyl-4-phenyl-4,5-dihydroimidazol-2-ol | Task: Please answer the multiple choice question.
Question: Which molecules are {toxicity_NR-Aromatase#not &NULL}{toxicity_NR-Aromatase__names__adjective}?
Constraint: You must select none, one or more options from {%multiple_choice_enum%2-5%aA1} without using any {#other|additional!} words.
Options:
{SMILES%toxicity_NR-Aromatase%}
Answer: {%multiple_choice_result} | Task: Please answer the multiple choice question.
Question: Which molecules are not toxic in the NR-Aromatase enzyme assay?
Constraint: You must select none, one or more options from a or b without using any additional words.
Options:
a.) C[C@H]1[C@@H](c2ccccc2)N=C(O)N1C
b.) OCCCCO
Answer: a, b |
|
TOX3235 | OC[C@@H](O)[C@@H](O)[C@H](O)[C@H](O)CO | 0 | train | OC[C@@H](O)[C@@H](O)[C@H](O)[C@H](O)CO | [O][C][C@@H1][Branch1][C][O][C@@H1][Branch1][C][O][C@H1][Branch1][C][O][C@H1][Branch1][C][O][C][O] | FBPFZTCFMRRESA-KVTDHHQDSA-N | (2R,3R,4R,5R)-hexane-1,2,3,4,5,6-hexol | Task: Please answer the multiple choice question.
Question: Which molecules are {toxicity_NR-Aromatase#not &NULL}{toxicity_NR-Aromatase__names__adjective}?
Constraint: You must select none, one or more options from {%multiple_choice_enum%2-5%aA1} without using any {#other|additional!} words.
Options:
{SMILES%toxicity_NR-Aromatase%}
Answer: {%multiple_choice_result} | Task: Please answer the multiple choice question.
Question: Which molecules are not toxic in the NR-Aromatase enzyme assay?
Constraint: You must select none, one or more options from a or b without using any other words.
Options:
a: O=Cc1ccccc1O
b: OC[C@@H](O)[C@@H](O)[C@H](O)[C@H](O)CO
Answer: a, b |
|
TOX26297 | O=[N+]([O-])c1cccc(S(=O)(=O)NCCNS(=O)(=O)c2cccc([N+](=O)[O-])c2)c1 | 0 | train | O=[N+]([O-])c1cccc(S(=O)(=O)NCCNS(=O)(=O)c2cccc([N+](=O)[O-])c2)c1 | [O][=N+1][Branch1][C][O-1][C][=C][C][=C][C][Branch2][Ring2][C][S][=Branch1][C][=O][=Branch1][C][=O][N][C][C][N][S][=Branch1][C][=O][=Branch1][C][=O][C][=C][C][=C][C][Branch1][=Branch1][N+1][=Branch1][C][=O][O-1][=C][Ring1][=Branch2][=C][Ring2][Ring1][=Branch2] | MMDWBZHWHFGVHF-UHFFFAOYSA-N | 3-nitro-N-[2-[(3-nitrophenyl)sulfonylamino]ethyl]benzenesulfonamide | Task: Please answer the multiple choice question.
Question: Which molecules are {toxicity_NR-Aromatase#not &NULL}{toxicity_NR-Aromatase__names__adjective}?
Constraint: You must select none, one or more options from {%multiple_choice_enum%2-5%aA1} without using any {#other|additional!} words.
Options:
{SMILES%toxicity_NR-Aromatase%}
Answer: {%multiple_choice_result} | Task: Please answer the multiple choice question.
Question: Which molecules are not toxic in the NR-Aromatase enzyme assay?
Constraint: You must select none, one or more options from a, b, or c without using any additional words.
Options:
(a) CC(C)[C@H]1CC[C@@H](C)CC1=O
(b) O=[N+]([O-])c1cccc(S(=O)(=O)NCCNS(=O)(=O)c2cccc([N+](=O)[O-])c2)c1
(c) CC(=O)c1ccc(C(C)=O)cc1
Answer: a, b, c |
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