task stringclasses 5
values | input stringlengths 89 339 |
|---|---|
chain_length | ### Instruction:
What is the length of the longest acyclic carbon chain in the molecule?
N#CN(CCc1ccccc1)c1ccc(F)c([N+](=O)[O-])c1
### Response:
2 |
chain_length | ### Instruction:
What is the length of the longest acyclic carbon chain in the molecule?
Cc1nc(CN(C)C(=O)[C@@H]2CC[NH2+][C@H]2C)n[nH]1
### Response:
1 |
functional_group | ### Instruction:
Does the molecule contain a nitrile group?
CCCCNC(=O)CCc1c(C)nc2c3ccccc3nn2c1C
### Response:
No |
functional_group | ### Instruction:
Does the molecule contain a amide group?
O=C([C@H]1CC(Cc2cccc(Cl)c2)=NO1)N1CCN(c2ncc3ccccc3n2)CC1
### Response:
Yes |
chain_length | ### Instruction:
What is the length of the longest acyclic carbon chain in the molecule?
C[C@@H](c1ccc(C(F)(F)F)cc1)[S@@](=O)Cc1cn2ccccc2n1
### Response:
2 |
canonicalization | ### Instruction:
Canonicalize the following SMILES string.
C(C)n1c(c(cc1C)C(CN1C(=O)N[C@@](c2ccc(cc2)C#N)(C1=O)C)=O)C
### Response:
CCn1c(C)cc(C(=O)CN2C(=O)N[C@@](C)(c3ccc(C#N)cc3)C2=O)c1C |
ring_counting | ### Instruction:
Count the six-membered rings in the following molecule.
O=S(=O)(Oc1cccnc1Cl)c1ccc(Cl)cc1
### Response:
2 |
chain_length | ### Instruction:
What is the length of the longest acyclic carbon chain in the molecule?
C[C@@H](Sc1nc2ccccc2s1)C(=O)NCC(C)(C)c1ccncc1
### Response:
3 |
fragment_assembly | ### Instruction:
Assemble these two molecular fragments into a single molecule.
Fragment 1: [14*]c1nc2ccc(Br)cc2c(=O)[nH]1
Fragment 2: [16*]c1cccc(C)c1
### Response:
Cc1cccc(-c2nc3ccc(Br)cc3c(=O)[nH]2)c1 |
canonicalization | ### Instruction:
Canonicalize the following SMILES string.
c1c(ccc(c1)F)S(=O)(N1CC(C1)C(=O)[O-])=O
### Response:
O=C([O-])C1CN(S(=O)(=O)c2ccc(F)cc2)C1 |
ring_counting | ### Instruction:
Count the six-membered rings in the following molecule.
O=C(Nc1cccnc1)c1ccc(NC(=O)c2ncn(-c3ccccc3)n2)cc1
### Response:
3 |
chain_length | ### Instruction:
What is the length of the longest acyclic carbon chain in the molecule?
CC[C@](C)(CCO)NC(=O)N[C@H]1CCCC[C@@H]1OC1CCCC1
### Response:
5 |
fragment_assembly | ### Instruction:
Assemble these two molecular fragments into a single molecule.
Fragment 1: [12*]S(=O)(=O)c1ccc([16*])cc1
Fragment 2: [5*]NC(=[NH2+])N[5*]
### Response:
Cc1cc(C)nc(NC(=[NH2+])Nc2ccc(S(=O)(=O)Nc3nccc(C)n3)cc2)n1 |
functional_group | ### Instruction:
Does the molecule contain a amide group?
O=C(CC[C@@H]1CCC[NH+](Cc2cccc3cccnc23)C1)N1CCCC1
### Response:
Yes |
functional_group | ### Instruction:
Does the molecule contain a aromatic_ring group?
CC[C@@H](C)NS(=O)(=O)Cc1cccc(NC(=O)[C@H]2CCOC2)c1
### Response:
Yes |
chain_length | ### Instruction:
What is the length of the longest acyclic carbon chain in the molecule?
CC1(C)CN(C(=O)c2ccc(Cl)cn2)CC[S@]1=O
### Response:
1 |
canonicalization | ### Instruction:
Canonicalize the following SMILES string.
c1c2c(cc(c1)OC)=[NH+]C(=O)[C@@H](CCNS(=O)(=O)c1ccc(OC)cc1)C=2
### Response:
COc1ccc(S(=O)(=O)NCC[C@H]2C=c3ccc(OC)cc3=[NH+]C2=O)cc1 |
chain_length | ### Instruction:
What is the length of the longest acyclic carbon chain in the molecule?
C[C@@H](O)CCCCn1c(=O)c2c(ncn2C)n(C)c1=O
### Response:
6 |
ring_counting | ### Instruction:
Count the six-membered rings in the following molecule.
COc1ccc([C@H](C)NS(=O)(=O)c2ccc3c(c2)CCO3)cc1F
### Response:
2 |
ring_counting | ### Instruction:
Count the six-membered rings in the following molecule.
C[C@@H]1Cc2ccccc2N1CC(=O)Nc1cc(C(F)(F)F)ccc1-n1cncn1
### Response:
2 |
fragment_assembly | ### Instruction:
Assemble these two molecular fragments into a single molecule.
Fragment 1: [5*]Nc1ccc(N[5*])cc1
Fragment 2: [5*]Nc1ccc([16*])cc1
### Response:
Cc1ccnc2nc(C(=O)Nc3ccc(Nc4ccccc4)cc3)nn12 |
fragment_assembly | ### Instruction:
Assemble these two molecular fragments into a single molecule.
Fragment 1: [5*][NH+]1CCC(CC)(CC)CC1
Fragment 2: [4*]CCCCS
### Response:
CCC1(CC)CC[NH+](CCCCS)CC1 |
chain_length | ### Instruction:
What is the length of the longest acyclic carbon chain in the molecule?
CCCNS(=O)(=O)c1ccc2c(c1)[C@H]1C=CC[C@@H]1[C@H](c1ccc(SC)cc1)N2
### Response:
3 |
canonicalization | ### Instruction:
Canonicalize the following SMILES string.
c1cc(c([C@H](CC(N2Cc3c(ccc([N+]([O-])=O)c3)CC2)=O)C)cc1)C
### Response:
Cc1ccccc1[C@@H](C)CC(=O)N1CCc2ccc([N+](=O)[O-])cc2C1 |
chain_length | ### Instruction:
What is the length of the longest acyclic carbon chain in the molecule?
O=C(NCCCCN1CCOCC1)C(=O)Nc1cccc(F)c1
### Response:
4 |
functional_group | ### Instruction:
Does the molecule contain a amide group?
CC(C)(C)OC(=O)N1CC[C@H](C(=O)N2CC[C@H]([NH+]3CCCC3)C2)C1
### Response:
Yes |
ring_counting | ### Instruction:
Count the six-membered rings in the following molecule.
COc1ncccc1CNC(=O)NC1CCC([NH+]2CCCCC2)CC1
### Response:
3 |
canonicalization | ### Instruction:
Canonicalize the following SMILES string.
c1(n(C)nc(-c2ccccc2)c1)C(NCC1(CO)CC1)=O
### Response:
Cn1nc(-c2ccccc2)cc1C(=O)NCC1(CO)CC1 |
chain_length | ### Instruction:
What is the length of the longest acyclic carbon chain in the molecule?
COc1ccccc1CC(=O)Nc1cc(C)ccc1NC(=O)C1CCCCC1
### Response:
2 |
fragment_assembly | ### Instruction:
Assemble these two molecular fragments into a single molecule.
Fragment 1: [10*]N1CCCC1=O
Fragment 2: [1*]C(=O)CC[8*]
### Response:
Cc1sc(NC(=O)CCN2CCCC2=O)c(C(N)=O)c1C |
canonicalization | ### Instruction:
Canonicalize the following SMILES string.
c1c(ccc(c1)Cl)OCc1nc([nH]n1)SCCC
### Response:
CCCSc1nc(COc2ccc(Cl)cc2)n[nH]1 |
chain_length | ### Instruction:
What is the length of the longest acyclic carbon chain in the molecule?
CS(=O)(=O)NC[C@H]1O[C@@H](CC(=O)N2CCN(c3cccc[nH+]3)CC2)[C@H](O)[C@@H]1O
### Response:
2 |
canonicalization | ### Instruction:
Canonicalize the following SMILES string.
c1c(c(S(=O)(=O)N2CCOCC2)cc2n(C)c(=O)c(n(c12)C)=O)C
### Response:
Cc1cc2c(cc1S(=O)(=O)N1CCOCC1)n(C)c(=O)c(=O)n2C |
functional_group | ### Instruction:
Does the molecule contain a aldehyde group?
COc1cccc(OC)c1OC1CC[NH+](Cc2ccc([C@H]3C[C@@H]3C)o2)CC1
### Response:
No |
fragment_assembly | ### Instruction:
Assemble these two molecular fragments into a single molecule.
Fragment 1: [1*]C(=O)C1=C(N)OC2=C(COC(C)=C2)[C@H]1[15*]
Fragment 2: [3*]OCC
### Response:
CCOC(=O)C1=C(N)OC2=C(COC(C)=C2)[C@H]1c1ccc(Cl)cc1Cl |
fragment_assembly | ### Instruction:
Assemble these two molecular fragments into a single molecule.
Fragment 1: [4*]Cc1ccc([16*])cn1
Fragment 2: [5*]N[C@H]1CCC(=O)N(C)C1=O
### Response:
CN1C(=O)CC[C@H](NCc2ccc(C(=O)[O-])cn2)C1=O |
canonicalization | ### Instruction:
Canonicalize the following SMILES string.
c1c(ncnc1C)SCCC(Nc1nc(-c2ccc(cc2)C)cs1)=O
### Response:
Cc1ccc(-c2csc(NC(=O)CCSc3cc(C)ncn3)n2)cc1 |
canonicalization | ### Instruction:
Canonicalize the following SMILES string.
c1(ccccc1OC)C(=O)NCS
### Response:
COc1ccccc1C(=O)NCS |
canonicalization | ### Instruction:
Canonicalize the following SMILES string.
C1CN(CCC1)c1c2c(n(c(c2C)C)-c2ccccc2)nc(n1)C(=O)Nc1ccc(F)cc1
### Response:
Cc1c(C)n(-c2ccccc2)c2nc(C(=O)Nc3ccc(F)cc3)nc(N3CCCCC3)c12 |
ring_counting | ### Instruction:
Count the six-membered rings in the following molecule.
CCO[C@H](C)n1cc(I)cn1
### Response:
0 |
fragment_assembly | ### Instruction:
Assemble these two molecular fragments into a single molecule.
Fragment 1: [4*]CC([6*])=O
Fragment 2: [15*]C1CC1
### Response:
Cc1cc(C(=O)CN(C)S(=O)(=O)c2ccc(F)cc2)c(C)n1C1CC1 |
fragment_assembly | ### Instruction:
Assemble these two molecular fragments into a single molecule.
Fragment 1: [5*]N1CC[C@H](C(N)=O)c2ccccc21
Fragment 2: [15*][C@H]1CCC[C@H](C)C1
### Response:
C[C@H]1CCC[C@H](OCC(=O)N2CC[C@H](C(N)=O)c3ccccc32)C1 |
canonicalization | ### Instruction:
Canonicalize the following SMILES string.
c1c(c(cc(N[C@H](C)C[NH+]2CCCCC2)[nH+]1)C)N
### Response:
Cc1cc(N[C@H](C)C[NH+]2CCCCC2)[nH+]cc1N |
canonicalization | ### Instruction:
Canonicalize the following SMILES string.
[NH2+](C)[C@](C([O-])=O)(C)CCSc1ccncc1
### Response:
C[NH2+][C@](C)(CCSc1ccncc1)C(=O)[O-] |
chain_length | ### Instruction:
What is the length of the longest acyclic carbon chain in the molecule?
CC[C@@H](C)NC(=O)c1ccc(S(=O)(=O)NC(C)(C)C)cc1
### Response:
4 |
canonicalization | ### Instruction:
Canonicalize the following SMILES string.
c1cc(OCC(Nc2c(cc(Br)cc2)C(C)C)=O)ccc1[N+](=O)[O-]
### Response:
CC(C)c1cc(Br)ccc1NC(=O)COc1ccc([N+](=O)[O-])cc1 |
canonicalization | ### Instruction:
Canonicalize the following SMILES string.
C1[NH+](CC(=O)N(C)C)CCN(CC1)C(=O)NCc1cscc1
### Response:
CN(C)C(=O)C[NH+]1CCCN(C(=O)NCc2ccsc2)CC1 |
ring_counting | ### Instruction:
Count the five-membered rings in the following molecule.
COCCC(=O)N[C@@H](C)c1ccc(-c2ccncc2)cc1
### Response:
0 |
functional_group | ### Instruction:
Does the molecule contain a ester group?
O=C(Nc1cncc2ccccc12)N[C@@H]1CCCc2occc21
### Response:
No |
functional_group | ### Instruction:
Does the molecule contain a nitro group?
COc1ccc(C[NH2+]C[C@@H](C(C)C)N2CCN(C)CC2)cc1O
### Response:
No |
canonicalization | ### Instruction:
Canonicalize the following SMILES string.
n1(CCOC)ncc(c1)NC(NC[C@@H]1CCN(c2ccc(F)c(F)c2)C1)=O
### Response:
COCCn1cc(NC(=O)NC[C@@H]2CCN(c3ccc(F)c(F)c3)C2)cn1 |
ring_counting | ### Instruction:
Count the five-membered rings in the following molecule.
CN(C)C(=O)C1CCN(C(=O)NCc2cn(-c3ccccc3)nn2)CC1
### Response:
1 |
functional_group | ### Instruction:
Does the molecule contain a sulfonyl group?
Cc1sc(C(=O)N(C)[C@H]2CCC[C@@H]2S(C)(=O)=O)cc1[N+](=O)[O-]
### Response:
Yes |
canonicalization | ### Instruction:
Canonicalize the following SMILES string.
c1c(C[NH3+])ccc(OCCCn2cccnc2=O)c1
### Response:
[NH3+]Cc1ccc(OCCCn2cccnc2=O)cc1 |
fragment_assembly | ### Instruction:
Assemble these two molecular fragments into a single molecule.
Fragment 1: [5*]N[C@@H]([8*])c1ccccn1
Fragment 2: [4*]Cc1cc(C)c(O)c(C)c1
### Response:
Cc1cc(C[NH+]2CCC[C@@H]([C@H](NC(=O)c3cccc(F)c3)c3ccccn3)C2)cc(C)c1O |
canonicalization | ### Instruction:
Canonicalize the following SMILES string.
[O-]C(/C(C#N)=C\c1occc1)=N\S(=O)(c1cccc(OC)c1)=O
### Response:
COc1cccc(S(=O)(=O)/N=C([O-])/C(C#N)=C\c2ccco2)c1 |
ring_counting | ### Instruction:
Count the six-membered rings in the following molecule.
Cc1ccc(C(=O)N/C(=C\c2cccs2)C(=O)NCCN2CCOCC2)cc1
### Response:
2 |
ring_counting | ### Instruction:
Count the five-membered rings in the following molecule.
Cc1ccc(Nc2nccc([C@@H]3CCCN3Cc3ccncc3)n2)nc1
### Response:
1 |
canonicalization | ### Instruction:
Canonicalize the following SMILES string.
O=C(CCOc1cccc(C)c1)Nc1ccc(-c2nnnn2C2CC2)cc1
### Response:
Cc1cccc(OCCC(=O)Nc2ccc(-c3nnnn3C3CC3)cc2)c1 |
canonicalization | ### Instruction:
Canonicalize the following SMILES string.
C(Nc1c(OC(F)F)cccc1)(N1CCN(CC1)C(=O)C1CCCC1)=O
### Response:
O=C(Nc1ccccc1OC(F)F)N1CCN(C(=O)C2CCCC2)CC1 |
fragment_assembly | ### Instruction:
Assemble these two molecular fragments into a single molecule.
Fragment 1: [4*]CC=C
Fragment 2: [9*]n1cccn1
### Response:
C=CC[NH+](Cc1cccc(-n2cccn2)c1)[C@H]1CCS(=O)(=O)C1 |
canonicalization | ### Instruction:
Canonicalize the following SMILES string.
C1C2CC3CC(CC1(NC(=O)NCCC(=O)OCC#C)C3)C2
### Response:
C#CCOC(=O)CCNC(=O)NC12CC3CC(CC(C3)C1)C2 |
ring_counting | ### Instruction:
Count the six-membered rings in the following molecule.
O=C(CSc1nnc(NC2CC2)s1)c1ccc2c(c1)CCC2
### Response:
1 |
canonicalization | ### Instruction:
Canonicalize the following SMILES string.
[C@@H]1(CC(C(=O)NCCC(C)C)C[C@H](O1)C)C
### Response:
CC(C)CCNC(=O)C1C[C@@H](C)O[C@@H](C)C1 |
chain_length | ### Instruction:
What is the length of the longest acyclic carbon chain in the molecule?
CN1CC(=O)N2CCN(Cc3nc4ccc(F)cc4[nH]3)C[C@H]2C1=O
### Response:
1 |
canonicalization | ### Instruction:
Canonicalize the following SMILES string.
O(C(=O)[C@@](NC(=O)c1cc(C2CC2)nc2ccc(cc21)F)(C)CC)C
### Response:
CC[C@@](C)(NC(=O)c1cc(C2CC2)nc2ccc(F)cc12)C(=O)OC |
canonicalization | ### Instruction:
Canonicalize the following SMILES string.
O=CNc1ccc(C(N2CCCC[C@@H]2c2[nH]c3c(cccc3)c2)=O)cc1
### Response:
O=CNc1ccc(C(=O)N2CCCC[C@@H]2c2cc3ccccc3[nH]2)cc1 |
chain_length | ### Instruction:
What is the length of the longest acyclic carbon chain in the molecule?
CC(C)[C@H](NC(=O)Cn1ccc(=O)c2ccccc21)c1ccccn1
### Response:
3 |
canonicalization | ### Instruction:
Canonicalize the following SMILES string.
Cc1ccc(cc1)-c1nn(C/C(N)=N/O)c(cc1)=O
### Response:
Cc1ccc(-c2ccc(=O)n(C/C(N)=N/O)n2)cc1 |
functional_group | ### Instruction:
Does the molecule contain a amide group?
O=C(CSc1ccc2c(c1)CCC2)Nc1nc(-c2ccc3c(c2)CCC(=O)N3)cs1
### Response:
Yes |
ring_counting | ### Instruction:
Count the six-membered rings in the following molecule.
O=C(NCCc1nc2ccccc2n1Cc1ccc(Cl)cc1)[C@@H]1CCCO1
### Response:
2 |
chain_length | ### Instruction:
What is the length of the longest acyclic carbon chain in the molecule?
COc1ccc(-c2n[nH]cc2C(=O)NCC(=O)NC(C)(C)C)cc1
### Response:
3 |
functional_group | ### Instruction:
Does the molecule contain a sulfonyl group?
CC[C@@H](/C([O-])=N/S(=O)(=O)c1cc(Cl)sc1Cl)c1ccccc1
### Response:
Yes |
chain_length | ### Instruction:
What is the length of the longest acyclic carbon chain in the molecule?
COC(=O)c1cccc2c1N[C@H](c1ccccc1OC)[C@@H]1CC=C[C@H]21
### Response:
1 |
chain_length | ### Instruction:
What is the length of the longest acyclic carbon chain in the molecule?
Cc1ccc(N(C)[C@@H](CN)c2ccc(Br)c(C)c2)c(C)c1
### Response:
2 |
chain_length | ### Instruction:
What is the length of the longest acyclic carbon chain in the molecule?
COc1cccc(OC)c1OC1CC[NH+](Cc2ccc([C@H]3C[C@@H]3C)o2)CC1
### Response:
1 |
chain_length | ### Instruction:
What is the length of the longest acyclic carbon chain in the molecule?
Cc1cc(NC(=O)[C@@H](c2ccccc2)N2CCCCC2=O)sn1
### Response:
2 |
fragment_assembly | ### Instruction:
Assemble these two molecular fragments into a single molecule.
Fragment 1: [5*]NCC(F)(F)F
Fragment 2: [4*]Cc1ccc(C#N)cc1
### Response:
N#Cc1ccc(CNS(=O)(=O)c2ccc(C(=O)NCC(F)(F)F)cc2)cc1 |
canonicalization | ### Instruction:
Canonicalize the following SMILES string.
c1ccncc1[C@@H](C)[NH2+]CC1(CCCCC1)CCO
### Response:
C[C@@H]([NH2+]CC1(CCO)CCCCC1)c1cccnc1 |
ring_counting | ### Instruction:
Count the five-membered rings in the following molecule.
O=C(NCc1ccco1)C(=O)Nc1cc(Cl)ccc1Cl
### Response:
1 |
chain_length | ### Instruction:
What is the length of the longest acyclic carbon chain in the molecule?
CC[C@@H](C#N)NC(=O)c1ccnc(OC2CCC2)c1
### Response:
4 |
functional_group | ### Instruction:
Does the molecule contain a halide group?
CCCC[C@]1(c2ccc(F)cc2)NC(=O)N(Cc2cc(=O)n3cccc(C)c3n2)C1=O
### Response:
Yes |
ring_counting | ### Instruction:
Count the five-membered rings in the following molecule.
COC(=O)N1CC[C@@H](Nc2ncnc3nc(N)ccc23)C1
### Response:
1 |
ring_counting | ### Instruction:
Count the five-membered rings in the following molecule.
C[C@@H](NC(=O)[C@H](Cc1ccccc1)NC(=O)c1ccco1)c1ccc2ccccc2c1
### Response:
1 |
fragment_assembly | ### Instruction:
Assemble these two molecular fragments into a single molecule.
Fragment 1: [10*]N1C(=O)c2oc3c(C)cc(C)cc3c(=O)c2[C@H]1c1ccc(SC)cc1
Fragment 2: [8*]CCOC
### Response:
COCCN1C(=O)c2oc3c(C)cc(C)cc3c(=O)c2[C@H]1c1ccc(SC)cc1 |
chain_length | ### Instruction:
What is the length of the longest acyclic carbon chain in the molecule?
CCN(CC)C(=O)NCc1cc(C#CC[NH3+])ccc1F
### Response:
3 |
fragment_assembly | ### Instruction:
Assemble these two molecular fragments into a single molecule.
Fragment 1: [16*]c1ccccc1
Fragment 2: [4*]CCN1CN([5*])C(=S)N([5*])C1
### Response:
S=C1N(c2ccccc2)CN(CCN2CCOCC2)CN1c1ccccc1 |
ring_counting | ### Instruction:
Count the five-membered rings in the following molecule.
CC(C)[NH+](CC(N)=O)CC(=O)N(C)c1ccc([N+](=O)[O-])cc1
### Response:
0 |
canonicalization | ### Instruction:
Canonicalize the following SMILES string.
O=[S@]1C(C)(CN(Cc2cc(ccc2)OCc2ccccn2)CC1)C
### Response:
CC1(C)CN(Cc2cccc(OCc3ccccn3)c2)CC[S@]1=O |
chain_length | ### Instruction:
What is the length of the longest acyclic carbon chain in the molecule?
COc1ccc(Cl)cc1N(CC(=O)NN=C1CCN(C)CC1)S(=O)(=O)c1ccc(C)cc1
### Response:
2 |
canonicalization | ### Instruction:
Canonicalize the following SMILES string.
O=S1(=O)N=C(c2cccc(c2)[N+](=O)[O-])[N-]c2c1cccc2
### Response:
O=[N+]([O-])c1cccc(C2=NS(=O)(=O)c3ccccc3[N-]2)c1 |
functional_group | ### Instruction:
Does the molecule contain a aromatic_ring group?
C[C@@H]1[NH2+]CCC[C@@H]1C(=O)Nc1cc(F)c(F)c(F)c1
### Response:
Yes |
functional_group | ### Instruction:
Does the molecule contain a carboxyl group?
CCn1ncnc1C[C@@H]([NH3+])[C@@H]1C[NH+](C)CCN1C
### Response:
No |
ring_counting | ### Instruction:
Count the five-membered rings in the following molecule.
CC1(C)C([NH2+][C@H]2CC[C@H]([NH3+])C2)C1(C)C
### Response:
1 |
chain_length | ### Instruction:
What is the length of the longest acyclic carbon chain in the molecule?
Cn1nc2c(cc1=O)CN(C(=O)NCc1csc(C3CC3)n1)CC2
### Response:
1 |
canonicalization | ### Instruction:
Canonicalize the following SMILES string.
C1CCC(C1)(c1c(F)cc(F)cc1)C(=O)NNC(=O)Cc1ccccn1
### Response:
O=C(Cc1ccccn1)NNC(=O)C1(c2ccc(F)cc2F)CCCC1 |
canonicalization | ### Instruction:
Canonicalize the following SMILES string.
C1CC[C@H]([C@H](O)C1)[C@H]1N(C(C2CCC2)=O)CCCC1
### Response:
O=C(C1CCC1)N1CCCC[C@H]1[C@@H]1CCCC[C@H]1O |
functional_group | ### Instruction:
Does the molecule contain a halide group?
CC(C)[C@@H](NC(=O)C[C@@H](C)c1ccc(F)cc1)C(=O)N1CCOCC1
### Response:
Yes |
functional_group | ### Instruction:
Does the molecule contain a nitro group?
C[C@H]1CCCN(C(=O)CN2CCO[C@H](CN(C)c3cccnn3)C2)C1
### Response:
No |
fragment_assembly | ### Instruction:
Assemble these two molecular fragments into a single molecule.
Fragment 1: [14*]c1ccco1
Fragment 2: [5*]Nc1ccc2ccn(C)c2c1
### Response:
Cn1ccc2ccc(NC(=O)C(=O)NC[C@@](C)(O)c3ccco3)cc21 |
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