task stringclasses 5
values | input stringlengths 89 339 |
|---|---|
fragment_assembly | ### Instruction:
Assemble these two molecular fragments into a single molecule.
Fragment 1: [1*]C(=O)CC[8*]
Fragment 2: [14*]c1nc2sc(C)c(C)c2c(=O)[nH]1
### Response:
Cc1ccc(-c2cnc(CCC(=O)O[C@H](C)c3nc4sc(C)c(C)c4c(=O)[nH]3)o2)cc1 |
chain_length | ### Instruction:
What is the length of the longest acyclic carbon chain in the molecule?
Cc1nc(C2CC[NH+](Cc3ccc(CSC(F)F)o3)CC2)no1
### Response:
1 |
canonicalization | ### Instruction:
Canonicalize the following SMILES string.
c1c(cc([C@@H]([C@H]2C[NH+]3CCN2CC3)O)cc1OC)OC
### Response:
COc1cc(OC)cc([C@H](O)[C@H]2C[NH+]3CCN2CC3)c1 |
chain_length | ### Instruction:
What is the length of the longest acyclic carbon chain in the molecule?
CSC(=S)n1c2ccccc2c2ccccc21
### Response:
1 |
canonicalization | ### Instruction:
Canonicalize the following SMILES string.
C(c1nnc(cc1)-n1nccc1)(=O)Nc1ccccc1Cl
### Response:
O=C(Nc1ccccc1Cl)c1ccc(-n2cccn2)nn1 |
chain_length | ### Instruction:
What is the length of the longest acyclic carbon chain in the molecule?
C[C@@H](NC(=O)[C@H]1C[C@@H]1c1ccco1)c1noc(-c2ccc(Cl)cc2)n1
### Response:
2 |
ring_counting | ### Instruction:
Count the five-membered rings in the following molecule.
O=C(CSc1cn[nH]n1)Nc1ccc2c(c1)C(=O)c1ccccc1C2=O
### Response:
1 |
chain_length | ### Instruction:
What is the length of the longest acyclic carbon chain in the molecule?
COc1ccc(S(=O)(=O)NCC[C@@H](O)c2ccccc2)cc1
### Response:
3 |
functional_group | ### Instruction:
Does the molecule contain a amide group?
CC(C)[C@H](NC(=O)[C@@H]1CC(=O)N(Cc2ccco2)C1)c1cccs1
### Response:
Yes |
chain_length | ### Instruction:
What is the length of the longest acyclic carbon chain in the molecule?
Cn1ncnc1NC(=O)NCc1nc(-c2ccccc2)cs1
### Response:
1 |
fragment_assembly | ### Instruction:
Assemble these two molecular fragments into a single molecule.
Fragment 1: [1*]C(=O)c1cc2ccccc2oc1=O
Fragment 2: [3*]OCc1c(OC)cccc1OC
### Response:
COc1cccc(OC)c1COC(=O)c1cc2ccccc2oc1=O |
canonicalization | ### Instruction:
Canonicalize the following SMILES string.
c1c(ccc(N2C(=O)/C(SC2=S)=C/c2ccc(C(=O)OC)cc2)c1)F
### Response:
COC(=O)c1ccc(/C=C2\SC(=S)N(c3ccc(F)cc3)C2=O)cc1 |
canonicalization | ### Instruction:
Canonicalize the following SMILES string.
O=C(C1=C(C(=O)N(CCCN2CCOCC2)[C@@H]1c1sccc1)[O-])c1ccc(cc1)C
### Response:
Cc1ccc(C(=O)C2=C([O-])C(=O)N(CCCN3CCOCC3)[C@@H]2c2cccs2)cc1 |
canonicalization | ### Instruction:
Canonicalize the following SMILES string.
Clc1ccc(cc1)COC1CN(C(=O)COc2ccc(OC)cc2)C1
### Response:
COc1ccc(OCC(=O)N2CC(OCc3ccc(Cl)cc3)C2)cc1 |
fragment_assembly | ### Instruction:
Assemble these two molecular fragments into a single molecule.
Fragment 1: [4*]C(C)(C)C(=O)OC
Fragment 2: [5*]NS(=O)(=O)c1c(C)noc1C
### Response:
COC(=O)C(C)(C)NS(=O)(=O)c1c(C)noc1C |
chain_length | ### Instruction:
What is the length of the longest acyclic carbon chain in the molecule?
COCC[C@@H](C)C(=O)N(C)[C@H](C)c1ccc(-n2cncn2)cc1
### Response:
4 |
ring_counting | ### Instruction:
Count the five-membered rings in the following molecule.
Cc1ccc2ncc(NC(=O)c3ccc(Cl)cc3)c(=O)n2c1
### Response:
0 |
chain_length | ### Instruction:
What is the length of the longest acyclic carbon chain in the molecule?
C[C@H](NC(=O)[C@@H]1C=C[C@@H]([NH3+])C1)c1ccc(C(F)(F)F)cc1
### Response:
2 |
canonicalization | ### Instruction:
Canonicalize the following SMILES string.
c1cc(C)ccc1-n1c(NCc2c(nccc2)OC2CCCC2)nnn1
### Response:
Cc1ccc(-n2nnnc2NCc2cccnc2OC2CCCC2)cc1 |
functional_group | ### Instruction:
Does the molecule contain a amide group?
CC1CCN(C(=O)c2ccc(NCc3ccco3)nc2)CC1
### Response:
Yes |
chain_length | ### Instruction:
What is the length of the longest acyclic carbon chain in the molecule?
O=C(COc1ccccc1Br)Nc1cc(Cl)ccc1-n1cncn1
### Response:
2 |
chain_length | ### Instruction:
What is the length of the longest acyclic carbon chain in the molecule?
CCC(C)(C)c1ccc(OC[C@H](C)C[NH3+])cc1
### Response:
4 |
chain_length | ### Instruction:
What is the length of the longest acyclic carbon chain in the molecule?
C[C@@H]1CCCN(C(=O)NCC(C)(C)c2ccncc2)CC1
### Response:
3 |
canonicalization | ### Instruction:
Canonicalize the following SMILES string.
C([NH+]1C[C@@H](CCC1)c1nn(c(=O)n1CC)C)c1ccc(OC)c(C)c1C
### Response:
CCn1c([C@@H]2CCC[NH+](Cc3ccc(OC)c(C)c3C)C2)nn(C)c1=O |
functional_group | ### Instruction:
Does the molecule contain a hydroxyl group?
O=C(CCNC(=O)[C@@H]1SCCc2ccccc21)NCc1cccnc1
### Response:
No |
functional_group | ### Instruction:
Does the molecule contain a aromatic_ring group?
CC[C@@H](C)[C@@H](Cl)c1cc(C)c(F)cc1F
### Response:
Yes |
canonicalization | ### Instruction:
Canonicalize the following SMILES string.
C1C[C@@H](N2CC[S@](C(C)(C2)C)=O)C=CC1
### Response:
CC1(C)CN([C@H]2C=CCCC2)CC[S@]1=O |
functional_group | ### Instruction:
Does the molecule contain a aromatic_ring group?
C[NH+](C)Cc1cc(NC(=O)CCCC(=O)N2CCCCCC2)[nH]n1
### Response:
No |
functional_group | ### Instruction:
Does the molecule contain a aromatic_ring group?
CC[NH+](Cc1ccccc1NC(C)=O)[C@@H]1CCN(c2ccccc2)C1=O
### Response:
Yes |
fragment_assembly | ### Instruction:
Assemble these two molecular fragments into a single molecule.
Fragment 1: [1*]C(=O)c1cnc2c(C)cccn2c1=O
Fragment 2: [3*]O[C@@H]([8*])CC
### Response:
CC[C@@H](OC(=O)c1cnc2c(C)cccn2c1=O)c1cccc(OC)c1 |
ring_counting | ### Instruction:
Count the six-membered rings in the following molecule.
C[C@@H](O)[C@@H](C)Nc1ccc2sccc2c1
### Response:
1 |
fragment_assembly | ### Instruction:
Assemble these two molecular fragments into a single molecule.
Fragment 1: [1*]C(=O)c1nnn([9*])c1C
Fragment 2: [1*]C(C)=O
### Response:
CC(=O)Nc1ccc(NC(=O)c2nnn(-c3ccc(C)c(C)c3)c2C)cc1 |
fragment_assembly | ### Instruction:
Assemble these two molecular fragments into a single molecule.
Fragment 1: [15*]C1CC1
Fragment 2: [1*]C(=O)C[4*]
### Response:
N#Cc1ccc(NCC(=O)N2CC[NH+](C3CC3)CC2)cc1 |
chain_length | ### Instruction:
What is the length of the longest acyclic carbon chain in the molecule?
C[C@H](NC(=O)N(C)Cc1ccc(N(C)C)cc1)C(=O)N1CCCCC1
### Response:
3 |
chain_length | ### Instruction:
What is the length of the longest acyclic carbon chain in the molecule?
COc1ccc(-n2cc(CNC(=O)c3nc4nccc(C)n4n3)nn2)cc1
### Response:
1 |
canonicalization | ### Instruction:
Canonicalize the following SMILES string.
c1cc(nc(n1)NCCc1sc(N)nn1)C1CCCC1
### Response:
Nc1nnc(CCNc2nccc(C3CCCC3)n2)s1 |
functional_group | ### Instruction:
Does the molecule contain a nitrile group?
Cc1nnc([S-])n1CC[NH3+]
### Response:
No |
fragment_assembly | ### Instruction:
Assemble these two molecular fragments into a single molecule.
Fragment 1: [5*]N(C)c1nc(C)c2ccc(OC)cc2n1
Fragment 2: [14*]c1nc(C)c2ccc(OC)cc2n1
### Response:
COc1ccc2c(C)nc(N(C)CC[NH+]3CCCC[C@@H]3C)nc2c1 |
ring_counting | ### Instruction:
Count the five-membered rings in the following molecule.
CO[C@]1(C)C[C@@H](N(C)C(=O)CNC(=O)c2cc(C)oc2C)C1(C)C
### Response:
1 |
chain_length | ### Instruction:
What is the length of the longest acyclic carbon chain in the molecule?
Cc1nccn1-c1cc(N2CCC(C(=O)N3CCN(c4ccc(O)cc4)CC3)CC2)ncn1
### Response:
1 |
ring_counting | ### Instruction:
Count the six-membered rings in the following molecule.
CCCNC(=O)N1C[C@@H](c2ccc(OC)cc2)[C@@H]2[C@H]1C1CC[NH+]2CC1
### Response:
4 |
chain_length | ### Instruction:
What is the length of the longest acyclic carbon chain in the molecule?
CSC[C@H](C)N(C)S(=O)(=O)N1CCc2ccccc2C1
### Response:
3 |
functional_group | ### Instruction:
Does the molecule contain a carboxyl group?
Cc1ccc(Cl)cc1NC(=O)[C@@H](C)n1ncc(-c2ccccc2)nc1=O
### Response:
No |
chain_length | ### Instruction:
What is the length of the longest acyclic carbon chain in the molecule?
COCCCNC(=O)CN1CCN(C(=O)Nc2ccncc2)CC1
### Response:
3 |
fragment_assembly | ### Instruction:
Assemble these two molecular fragments into a single molecule.
Fragment 1: [10*]N1CCC(=O)NC2(CCCC2)C1=O
Fragment 2: [8*]CN1CCC(=O)NC2(CCCC2)C1=O
### Response:
CC1(C)C(CN2CCC(=O)NC3(CCCC3)C2=O)C1(C)C |
ring_counting | ### Instruction:
Count the five-membered rings in the following molecule.
Cc1ccc(-n2nc(S[C@H](C)C(=O)Nc3ccccc3C)ccc2=O)cc1Cl
### Response:
0 |
chain_length | ### Instruction:
What is the length of the longest acyclic carbon chain in the molecule?
COc1ccc(NC(=O)NCCc2ccc(N(C)C)cc2)c(OC)c1
### Response:
2 |
ring_counting | ### Instruction:
Count the six-membered rings in the following molecule.
CC[C@@H](CNC(=O)NC1CCCC1)c1ccccc1
### Response:
1 |
canonicalization | ### Instruction:
Canonicalize the following SMILES string.
C1[NH+](CCCN(C1)Cc1cn2ccccc2c1C#N)Cc1ccccc1
### Response:
N#Cc1c(CN2CCC[NH+](Cc3ccccc3)CC2)cn2ccccc12 |
canonicalization | ### Instruction:
Canonicalize the following SMILES string.
c1c(ccc(c1)I)C(N1CC[C@@H]([C@H](C)C1)[NH3+])=O
### Response:
C[C@@H]1CN(C(=O)c2ccc(I)cc2)CC[C@@H]1[NH3+] |
canonicalization | ### Instruction:
Canonicalize the following SMILES string.
c1c(NC(=O)c2c(nc(s2)C2CCCC2)C)cc2NC(COc2c1)=O
### Response:
Cc1nc(C2CCCC2)sc1C(=O)Nc1ccc2c(c1)NC(=O)CO2 |
functional_group | ### Instruction:
Does the molecule contain a amide group?
CSc1ncc(CNC(=O)CC2CC[NH+](C(C)C)CC2)n1C
### Response:
Yes |
fragment_assembly | ### Instruction:
Assemble these two molecular fragments into a single molecule.
Fragment 1: [11*]S[C@@H]1CCCc2ccccc21
Fragment 2: [14*]c1nnc([14*])n1N
### Response:
COCCc1nnc(S[C@@H]2CCCc3ccccc32)n1N |
ring_counting | ### Instruction:
Count the six-membered rings in the following molecule.
COc1ccc(Cc2nn3c(=O)/c(=C\c4ccccc4OC)sc3nc2=O)cc1
### Response:
3 |
ring_counting | ### Instruction:
Count the six-membered rings in the following molecule.
COc1ccc(-c2nn(-c3ccccc3)cc2C(=O)OCCCl)cc1
### Response:
2 |
chain_length | ### Instruction:
What is the length of the longest acyclic carbon chain in the molecule?
COC(=O)/C=C/CBr
### Response:
4 |
ring_counting | ### Instruction:
Count the five-membered rings in the following molecule.
Cn1cccc(C(=O)NCc2cc(-c3ccc4c(c3)OCCO4)on2)c1=O
### Response:
1 |
chain_length | ### Instruction:
What is the length of the longest acyclic carbon chain in the molecule?
C#CCn1/c(=N/C(=O)CCOc2ccccc2)sc2cc(F)ccc21
### Response:
3 |
functional_group | ### Instruction:
Does the molecule contain a carboxyl group?
C[C@@H]1CN(C(=O)NC(=O)c2ccc(F)c(Cl)c2)C[C@@H](C)O1
### Response:
No |
ring_counting | ### Instruction:
Count the five-membered rings in the following molecule.
O=C(NCCc1nc2ccccc2[nH]1)N1CCN(c2ccccc2F)CC1
### Response:
1 |
functional_group | ### Instruction:
Does the molecule contain a aldehyde group?
NC(=O)c1n[nH]c2ccc(NC(=O)c3cccc4cn[nH]c34)cc12
### Response:
No |
canonicalization | ### Instruction:
Canonicalize the following SMILES string.
c1cc(cc2OCOc12)N1C(C[C@@H](C1)C(NCc1c(OC)nccc1)=O)=O
### Response:
COc1ncccc1CNC(=O)[C@H]1CC(=O)N(c2ccc3c(c2)OCO3)C1 |
ring_counting | ### Instruction:
Count the six-membered rings in the following molecule.
O=C([C@H]1CN(C(=O)C2=CN3CCS(=O)(=O)N=C3C=C2)c2ccccc2O1)N1CCOCC1
### Response:
5 |
chain_length | ### Instruction:
What is the length of the longest acyclic carbon chain in the molecule?
Cc1cc(C)n2nc(SCC(=O)N(C3CCC(C)CC3)C3CC3)nc2n1
### Response:
2 |
chain_length | ### Instruction:
What is the length of the longest acyclic carbon chain in the molecule?
CCCN1CCO[C@@H](c2ccc(C)cc2C)C1
### Response:
3 |
chain_length | ### Instruction:
What is the length of the longest acyclic carbon chain in the molecule?
CCCc1cc(NC(=O)N[C@@H]2CCC[C@H](C(F)(F)F)C2)n(C)n1
### Response:
3 |
chain_length | ### Instruction:
What is the length of the longest acyclic carbon chain in the molecule?
O[C@@H](CN1CCN(c2cc(Cl)ncn2)CC1)c1ccc(Cl)cc1
### Response:
2 |
fragment_assembly | ### Instruction:
Assemble these two molecular fragments into a single molecule.
Fragment 1: [14*]c1cccs1
Fragment 2: [5*]NCc1ccccc1OC
### Response:
COc1ccccc1CNC(=O)c1cn[nH]c1-c1cccs1 |
ring_counting | ### Instruction:
Count the five-membered rings in the following molecule.
c1ccc(OCC[NH+]2CCN(c3ccccc3)CC2)cc1
### Response:
0 |
fragment_assembly | ### Instruction:
Assemble these two molecular fragments into a single molecule.
Fragment 1: [7*]Cc1cc([16*])c2ccccc2n1
Fragment 2: [7*]Cc1cc(C#N)n(C)c1C
### Response:
Cc1c(/C=C/c2cc(C(=O)[O-])c3ccccc3n2)cc(C#N)n1C |
fragment_assembly | ### Instruction:
Assemble these two molecular fragments into a single molecule.
Fragment 1: [10*]N1CCCCCC1=O
Fragment 2: [16*]c1c(F)cc(C#C)cc1F
### Response:
C#Cc1cc(F)c(NC(=O)NCCCN2CCCCCC2=O)c(F)c1 |
fragment_assembly | ### Instruction:
Assemble these two molecular fragments into a single molecule.
Fragment 1: [16*]c1ccccc1
Fragment 2: [8*][C@@H](OC)C(=O)N/N=C(\C)c1ccc(O)cc1
### Response:
CO[C@@H](C(=O)N/N=C(\C)c1ccc(O)cc1)c1ccccc1 |
chain_length | ### Instruction:
What is the length of the longest acyclic carbon chain in the molecule?
COc1c(F)cc(NC(=O)C(=O)N[C@H](C)c2ccc3c(c2)CCCC3)cc1F
### Response:
2 |
chain_length | ### Instruction:
What is the length of the longest acyclic carbon chain in the molecule?
O=C1/C(=C\c2ccc(Cl)cc2)S(=O)(=O)[C@@H](c2ccccc2)N1c1ccccc1
### Response:
1 |
fragment_assembly | ### Instruction:
Assemble these two molecular fragments into a single molecule.
Fragment 1: [1*]C(=O)c1oc2ccccc2c1C
Fragment 2: [5*]N1CCO[C@]([13*])(C)C1
### Response:
Cc1c(C(=O)N2CCO[C@@](C)(C(N)=O)C2)oc2ccccc12 |
ring_counting | ### Instruction:
Count the five-membered rings in the following molecule.
CC(C)OC(=O)[C@H](C)CNC(=O)N1CCO[C@H](c2ccccc2Cl)C1
### Response:
0 |
fragment_assembly | ### Instruction:
Assemble these two molecular fragments into a single molecule.
Fragment 1: [16*]c1cccc([N+](=O)[O-])c1
Fragment 2: [6*]C(=O)NNc1ncnc2c1cnn2C
### Response:
Cn1ncc2c(NNC(=O)c3cccc([N+](=O)[O-])c3)ncnc21 |
chain_length | ### Instruction:
What is the length of the longest acyclic carbon chain in the molecule?
CCC[C@H](C)N1C[C@H](C(=O)N2CCc3ccc([N+](=O)[O-])cc3C2)CC1=O
### Response:
5 |
canonicalization | ### Instruction:
Canonicalize the following SMILES string.
C1(N(CCc2ccccc2)C[C@@H](C(=O)OCC(=O)NC(=O)NC)C1)=O
### Response:
CNC(=O)NC(=O)COC(=O)[C@H]1CC(=O)N(CCc2ccccc2)C1 |
canonicalization | ### Instruction:
Canonicalize the following SMILES string.
C1C[C@](CN(C1)C(=O)C[C@@H](COC)C)(CC)C([O-])=O
### Response:
CC[C@]1(C(=O)[O-])CCCN(C(=O)C[C@H](C)COC)C1 |
chain_length | ### Instruction:
What is the length of the longest acyclic carbon chain in the molecule?
CSCc1ccc(NC(=O)c2cc(F)c(F)cc2[N+](=O)[O-])cc1
### Response:
1 |
ring_counting | ### Instruction:
Count the six-membered rings in the following molecule.
CCn1c(CC[NH3+])nnc1Sc1ncnc2ccc(F)cc12
### Response:
2 |
canonicalization | ### Instruction:
Canonicalize the following SMILES string.
o1c(C)c(cc1C)C[NH+]1CCC(CC1)CNC(C(Nc1c(OC)ccc(c1)C)=O)=O
### Response:
COc1ccc(C)cc1NC(=O)C(=O)NCC1CC[NH+](Cc2cc(C)oc2C)CC1 |
fragment_assembly | ### Instruction:
Assemble these two molecular fragments into a single molecule.
Fragment 1: [5*]NC1CCCCC1
Fragment 2: [3*]OCC
### Response:
CCOc1cc(Br)ccc1C(=O)NC1CCCCC1 |
functional_group | ### Instruction:
Does the molecule contain a aromatic_ring group?
Cc1ccc(CNC(=O)N(C)[C@@H](C)c2ccc(C)cc2)cc1
### Response:
Yes |
canonicalization | ### Instruction:
Canonicalize the following SMILES string.
C(c1ccc(c(O)c1)O)CNc1n2ncnc2nc(C)c1C
### Response:
Cc1nc2ncnn2c(NCCc2ccc(O)c(O)c2)c1C |
chain_length | ### Instruction:
What is the length of the longest acyclic carbon chain in the molecule?
Cc1csc(SCc2ccc(C(=O)N3CCN(C[C@@H]4CCCO4)CC3)cc2)n1
### Response:
1 |
fragment_assembly | ### Instruction:
Assemble these two molecular fragments into a single molecule.
Fragment 1: [5*]N(C)S(=O)(=O)c1cc([16*])c(F)c(F)c1
Fragment 2: [16*]c1cccc(C#C)c1
### Response:
C#Cc1cccc(N(C)S(=O)(=O)c2cc(F)c(F)c(C(=O)[O-])c2)c1 |
chain_length | ### Instruction:
What is the length of the longest acyclic carbon chain in the molecule?
c1coc(C[NH2+]C2CCCC2)c1
### Response:
1 |
chain_length | ### Instruction:
What is the length of the longest acyclic carbon chain in the molecule?
COc1cc(C)c(NC(=O)c2cc(Br)ccc2I)cc1OC
### Response:
1 |
chain_length | ### Instruction:
What is the length of the longest acyclic carbon chain in the molecule?
CCOC(=O)c1c(-c2ccccc2)csc1NC(=O)c1ccncc1
### Response:
2 |
functional_group | ### Instruction:
Does the molecule contain a sulfonyl group?
C[C@@H](Cn1cncn1)Nc1ccc2nnc(-c3ccccc3F)n2n1
### Response:
No |
fragment_assembly | ### Instruction:
Assemble these two molecular fragments into a single molecule.
Fragment 1: [10*]N1CNc2ccccc2C1=O
Fragment 2: [8*][C@H](C)C(=O)/N=c1/[nH]c2ccccc2s1
### Response:
C[C@H](C(=O)/N=c1/[nH]c2ccccc2s1)N1CNc2ccccc2C1=O |
canonicalization | ### Instruction:
Canonicalize the following SMILES string.
C([C@H]1CN(CCO1)Cc1ccccc1)(=O)NCCC(Nc1ccccc1)=O
### Response:
O=C(CCNC(=O)[C@H]1CN(Cc2ccccc2)CCO1)Nc1ccccc1 |
fragment_assembly | ### Instruction:
Assemble these two molecular fragments into a single molecule.
Fragment 1: [1*]C(=O)c1ccccc1C#N
Fragment 2: [5*]NCc1c(CC)nn(C)c1OC
### Response:
CCc1nn(C)c(OC)c1CNC(=O)c1ccccc1C#N |
ring_counting | ### Instruction:
Count the five-membered rings in the following molecule.
CCc1n[nH]c(=S)n1CCNC(=O)c1cc(C)nc2c1c(=O)[nH]n2C
### Response:
2 |
chain_length | ### Instruction:
What is the length of the longest acyclic carbon chain in the molecule?
COc1ccc(F)cc1NC(=O)c1ccnc(OC2CCC2)c1
### Response:
1 |
fragment_assembly | ### Instruction:
Assemble these two molecular fragments into a single molecule.
Fragment 1: [3*]Oc1ccc(Cl)cc1Cl
Fragment 2: [5*]Nc1cc(C)ccc1OC
### Response:
COc1ccc(C)cc1NC(=O)CNC(=O)COc1ccc(Cl)cc1Cl |
functional_group | ### Instruction:
Does the molecule contain a ether group?
O=C(Cc1cn2ccccc2n1)NCc1ccccc1Cn1ccnc1
### Response:
No |
chain_length | ### Instruction:
What is the length of the longest acyclic carbon chain in the molecule?
CN1C(=O)C[C@H](NC(=O)[C@@]2(C)CC2(Cl)Cl)[C@H]1c1ccc(Cl)cc1
### Response:
1 |
Subsets and Splits
No community queries yet
The top public SQL queries from the community will appear here once available.