task stringclasses 5
values | input stringlengths 89 339 |
|---|---|
fragment_assembly | ### Instruction:
Assemble these two molecular fragments into a single molecule.
Fragment 1: [5*]Nc1sc2c(c1[16*])CCCC2
Fragment 2: [1*]C(=O)c1ccccc1I
### Response:
CNC(=O)c1c(NC(=O)c2ccccc2I)sc2c1CCCC2 |
canonicalization | ### Instruction:
Canonicalize the following SMILES string.
c1n2nc[nH]c(=O)c2c(C)c1C(=O)NCC(N1c2c(cccc2)CC1)=O
### Response:
Cc1c(C(=O)NCC(=O)N2CCc3ccccc32)cn2nc[nH]c(=O)c12 |
functional_group | ### Instruction:
Does the molecule contain a nitrile group?
Cc1nn(Cc2nc3c4cnn(C)c4ncn3n2)c(C)c1Cl
### Response:
No |
canonicalization | ### Instruction:
Canonicalize the following SMILES string.
N(CC(=O)N1CCCCC1)[C@H](c1ccc(C)cc1)c1ccccc1
### Response:
Cc1ccc([C@@H](NCC(=O)N2CCCCC2)c2ccccc2)cc1 |
fragment_assembly | ### Instruction:
Assemble these two molecular fragments into a single molecule.
Fragment 1: [5*]N1CCC([15*])(O)CC1
Fragment 2: [8*]C(F)(F)F
### Response:
O=S(=O)(c1cccnc1)N1CCC(O)(C(F)(F)F)CC1 |
fragment_assembly | ### Instruction:
Assemble these two molecular fragments into a single molecule.
Fragment 1: [3*]OCC
Fragment 2: [1*]C(=O)OCC
### Response:
C=C1C[C@]2(C)C(=CC1=O)CC[C@@H]1[C@H]2CC[C@@]2(C)[C@@H](OC(=O)OCC)CC[C@@H]12 |
ring_counting | ### Instruction:
Count the five-membered rings in the following molecule.
CCC[C@@H](C)NC(=O)[C@@H]1CCCN(C(=O)Nc2ccc(C)c(OCC)c2)C1
### Response:
0 |
functional_group | ### Instruction:
Does the molecule contain a aromatic_ring group?
CN(Cc1cc2cc(F)ccc2[nH]1)C(=O)[C@H]1C=C(COc2ccc3c(c2)CCCC3)ON1
### Response:
Yes |
canonicalization | ### Instruction:
Canonicalize the following SMILES string.
[C@H](C[NH+]1[C@H]2CC(O)C[C@@H]1CC2)(CS)c1ccccc1
### Response:
OC1C[C@H]2CC[C@@H](C1)[NH+]2C[C@@H](CS)c1ccccc1 |
canonicalization | ### Instruction:
Canonicalize the following SMILES string.
c1c(-c2c(nn3c(N4CCC(CC4)C(=O)N[C@H](CC)C)cc(nc32)C)C)ccc(c1)Cl
### Response:
CC[C@H](C)NC(=O)C1CCN(c2cc(C)nc3c(-c4ccc(Cl)cc4)c(C)nn23)CC1 |
functional_group | ### Instruction:
Does the molecule contain a aromatic_ring group?
O=C(C[NH+]1CCN(C(=O)c2ccco2)CC1)Nc1c2c(nc3ccccc13)CCC2
### Response:
Yes |
chain_length | ### Instruction:
What is the length of the longest acyclic carbon chain in the molecule?
O=C(COc1ccc(N2CCCC2=O)cc1)NNc1ccc(F)cc1
### Response:
2 |
ring_counting | ### Instruction:
Count the six-membered rings in the following molecule.
O=C1CCN(CCOC(=O)Cc2ccccc2)c2ccc(F)cc2N1
### Response:
2 |
chain_length | ### Instruction:
What is the length of the longest acyclic carbon chain in the molecule?
Cc1cc(C(=O)Cn2c(C(F)(F)F)nc3ccccc32)c(C)n1-c1nccs1
### Response:
2 |
canonicalization | ### Instruction:
Canonicalize the following SMILES string.
C(Cn1nnc2ccccc21)(N(CC(=O)Nc1cc2c(OCO2)cc1)Cc1ccccc1)=O
### Response:
O=C(CN(Cc1ccccc1)C(=O)Cn1nnc2ccccc21)Nc1ccc2c(c1)OCO2 |
canonicalization | ### Instruction:
Canonicalize the following SMILES string.
C(c1ccccc1)Cc1nc(cs1)Cn1c2c(scc2)c(=O)cc1
### Response:
O=c1ccn(Cc2csc(CCc3ccccc3)n2)c2ccsc12 |
canonicalization | ### Instruction:
Canonicalize the following SMILES string.
C1N(CCNc2nc(c3c(n(C)nc3)n2)Nc2ccc(cc2)C)CCOC1
### Response:
Cc1ccc(Nc2nc(NCCN3CCOCC3)nc3c2cnn3C)cc1 |
chain_length | ### Instruction:
What is the length of the longest acyclic carbon chain in the molecule?
CC[NH+]1CCCC[C@@H]1C(=O)N1CCOc2ccc([C@H](O)C3CCCCC3)cc2C1
### Response:
2 |
functional_group | ### Instruction:
Does the molecule contain a thiol group?
O=C(C[N+]12CCC(CC1)[C@H](O)C2)c1ccc(Br)cc1
### Response:
No |
functional_group | ### Instruction:
Does the molecule contain a sulfonyl group?
Cc1ccc(NC(=O)c2[nH]nc(C3CC3)c2Cl)cc1N1CCOC1=O
### Response:
No |
chain_length | ### Instruction:
What is the length of the longest acyclic carbon chain in the molecule?
Cc1cccnc1C[NH+]1CCC(O)CC1
### Response:
1 |
fragment_assembly | ### Instruction:
Assemble these two molecular fragments into a single molecule.
Fragment 1: [5*]N1CCOC[C@@H]1CC
Fragment 2: [4*]Cc1cccc(C)c1C
### Response:
CC[C@H]1COCCN1Cc1cccc(C)c1C |
functional_group | ### Instruction:
Does the molecule contain a carboxyl group?
CC(=O)N1CCCc2cc(NC(=O)c3ccc(-n4ccnn4)cc3)ccc21
### Response:
No |
functional_group | ### Instruction:
Does the molecule contain a ketone group?
CC(=O)[C@@H]1CCCCC1(C)C
### Response:
Yes |
canonicalization | ### Instruction:
Canonicalize the following SMILES string.
c1cccc([C@@H]([C@H](C)[NH3+])CC([O-])=O)c1
### Response:
C[C@H]([NH3+])[C@@H](CC(=O)[O-])c1ccccc1 |
functional_group | ### Instruction:
Does the molecule contain a amide group?
CC[NH+](CC)CC(=O)NN1c2ccccc2CCc2ccccc21
### Response:
Yes |
ring_counting | ### Instruction:
Count the five-membered rings in the following molecule.
CSc1ccc(O[C@@H](C)C(=O)Nc2c(C)cnn2-c2ccccc2)cc1
### Response:
1 |
canonicalization | ### Instruction:
Canonicalize the following SMILES string.
c1(c(F)cccc1Cl)C(N1CC(=O)Nc2ccc(cc2[C@@H]1c1ccccc1)Cl)=O
### Response:
O=C1CN(C(=O)c2c(F)cccc2Cl)[C@@H](c2ccccc2)c2cc(Cl)ccc2N1 |
functional_group | ### Instruction:
Does the molecule contain a phenol group?
CCN(Cc1cccc(NC(=O)N(C)CCc2ccccn2)c1)C(C)=O
### Response:
No |
canonicalization | ### Instruction:
Canonicalize the following SMILES string.
C1CN(CCCn2c3c(c4c(C(C[C@H](C)C4)=O)cn3)c([nH]c2=O)=O)CCO1
### Response:
C[C@H]1CC(=O)c2cnc3c(c2C1)c(=O)[nH]c(=O)n3CCCN1CCOCC1 |
fragment_assembly | ### Instruction:
Assemble these two molecular fragments into a single molecule.
Fragment 1: [1*]C(=O)CC[8*]
Fragment 2: [5*]N1CCC([15*])CC1
### Response:
[NH3+]CCCOC1CCN(C(=O)CCn2cc[nH+]c2)CC1 |
functional_group | ### Instruction:
Does the molecule contain a nitrile group?
O=C(NC[C@H]1CC[C@@H](C(=O)[O-])O1)c1cccn1C1CC1
### Response:
No |
fragment_assembly | ### Instruction:
Assemble these two molecular fragments into a single molecule.
Fragment 1: [1*]C(=O)[C@H]([4*])C
Fragment 2: [5*]N[C@H]1CCCC[C@@H]1C
### Response:
COc1ccc(N[C@H](C)C(=O)N[C@H]2CCCC[C@@H]2C)c(OC)c1 |
ring_counting | ### Instruction:
Count the five-membered rings in the following molecule.
C[NH2+][C@H](Cc1cc(Cl)ccc1OC)c1c(F)cccc1F
### Response:
0 |
fragment_assembly | ### Instruction:
Assemble these two molecular fragments into a single molecule.
Fragment 1: [1*]C(=O)NC
Fragment 2: [1*]C(=O)CN[5*]
### Response:
CCC(CC)c1nnc(NC(=O)CNC(=O)NC)s1 |
chain_length | ### Instruction:
What is the length of the longest acyclic carbon chain in the molecule?
O=C(Nc1cccc(NC(=O)c2cccs2)c1)C(=O)NC1CCCCCCC1
### Response:
2 |
fragment_assembly | ### Instruction:
Assemble these two molecular fragments into a single molecule.
Fragment 1: [5*]N1CCC[C@@H]2CCCC[C@H]21
Fragment 2: [9*]n1cnc2c(oc3ccccc32)c1=O
### Response:
O=C(Cn1cnc2c(oc3ccccc32)c1=O)N1CCC[C@@H]2CCCC[C@H]21 |
ring_counting | ### Instruction:
Count the six-membered rings in the following molecule.
CCC[NH+](C)C[C@@H]1CCN(Cc2cc(Br)ccc2[N+](=O)[O-])C1
### Response:
1 |
functional_group | ### Instruction:
Does the molecule contain a amine group?
Cc1ccc([C@@H](C)N[C@@H](c2nc(C3CC3)no2)C(C)C)o1
### Response:
Yes |
canonicalization | ### Instruction:
Canonicalize the following SMILES string.
s1c(NC(=O)Cc2cccc3ccccc32)nnc1S(Cc1ccc(Cl)cc1)(=O)=O
### Response:
O=C(Cc1cccc2ccccc12)Nc1nnc(S(=O)(=O)Cc2ccc(Cl)cc2)s1 |
fragment_assembly | ### Instruction:
Assemble these two molecular fragments into a single molecule.
Fragment 1: [5*]Nc1ccc2c(c1)OCO2
Fragment 2: [1*]C(=O)c1cnc2[nH]ccc2c1
### Response:
O=C(Nc1ccc2c(c1)OCO2)c1cnc2[nH]ccc2c1 |
ring_counting | ### Instruction:
Count the six-membered rings in the following molecule.
O=C(c1ccc(F)c(F)c1F)N1CCCCCC1
### Response:
1 |
chain_length | ### Instruction:
What is the length of the longest acyclic carbon chain in the molecule?
COc1ncnc(N[C@H](C)Cn2cc[nH+]c2)c1N
### Response:
3 |
fragment_assembly | ### Instruction:
Assemble these two molecular fragments into a single molecule.
Fragment 1: [16*]c1ccncc1
Fragment 2: [1*]C(=O)C1C(C)=NC2=C(C(=O)CCC2)[C@H]1[15*]
### Response:
CCOC(=O)C1C(C)=NC2=C(C(=O)CCC2)[C@H]1c1ccncc1 |
fragment_assembly | ### Instruction:
Assemble these two molecular fragments into a single molecule.
Fragment 1: [8*]C(C)(C)C
Fragment 2: [4*]Cc1cn[nH]c1[14*]
### Response:
Cc1cc(C(F)(F)F)n2nc([C@H]3CCC[NH+]3Cc3cn[nH]c3C(C)(C)C)cc2n1 |
fragment_assembly | ### Instruction:
Assemble these two molecular fragments into a single molecule.
Fragment 1: [16*]c1ccncc1
Fragment 2: [1*]C(=O)c1ccc(F)cc1
### Response:
CC(C)[C@H](NC(=O)c1ccc(F)cc1)C(=O)NNC(=O)c1ccncc1 |
ring_counting | ### Instruction:
Count the five-membered rings in the following molecule.
Cc1cc(N)cc(S(=O)(=O)[N-]c2ccccc2C#N)c1
### Response:
0 |
chain_length | ### Instruction:
What is the length of the longest acyclic carbon chain in the molecule?
COc1cc([C@H]2CC(=O)Nc3ncn(-c4ccc(C(F)(F)F)cc4)c32)cc2c1OCO2
### Response:
1 |
fragment_assembly | ### Instruction:
Assemble these two molecular fragments into a single molecule.
Fragment 1: [14*]c1cccs1
Fragment 2: [5*]NCC[8*]
### Response:
C[C@H]1CCC[C@H](C)[NH+]1CC(=O)NC(=O)NCCc1cccs1 |
chain_length | ### Instruction:
What is the length of the longest acyclic carbon chain in the molecule?
Cc1csc([C@@H](C)NC(=O)N2CCC[NH+](CCCc3ccccc3)CC2)n1
### Response:
3 |
fragment_assembly | ### Instruction:
Assemble these two molecular fragments into a single molecule.
Fragment 1: [16*]c1cc(C)c(Cl)c(C)c1
Fragment 2: [5*]Nc1c(C)cccc1CC
### Response:
CCc1cccc(C)c1NC(=O)COc1cc(C)c(Cl)c(C)c1 |
ring_counting | ### Instruction:
Count the six-membered rings in the following molecule.
O=C(Nc1cccc(S(=O)(=O)/N=C2/CCCN2)c1)C1=Cc2ccccc2OC1
### Response:
3 |
chain_length | ### Instruction:
What is the length of the longest acyclic carbon chain in the molecule?
Cc1ccc(CN2CCOC3(CCC3)C2)cc1C
### Response:
1 |
chain_length | ### Instruction:
What is the length of the longest acyclic carbon chain in the molecule?
CN(Cc1cccc(O)c1)C(=O)c1cccc(NC(=O)c2ccc(F)cc2)c1
### Response:
1 |
canonicalization | ### Instruction:
Canonicalize the following SMILES string.
c12c(ccc(c1)C(=O)Nc1cccc(Br)c1)N1CCS(N=C1S2)(=O)=O
### Response:
O=C(Nc1cccc(Br)c1)c1ccc2c(c1)SC1=NS(=O)(=O)CCN12 |
fragment_assembly | ### Instruction:
Assemble these two molecular fragments into a single molecule.
Fragment 1: [5*]N1CCO[C@H](CC)C1
Fragment 2: [15*][C@@H]1CCC[C@@](CO)([NH2+]C)C1
### Response:
CC[C@@H]1CN([C@@H]2CCC[C@@](CO)([NH2+]C)C2)CCO1 |
ring_counting | ### Instruction:
Count the six-membered rings in the following molecule.
Cc1ccc(C(=O)C2=C([O-])C(=O)N(C)[C@@H]2c2ccc(I)cc2)cc1
### Response:
2 |
functional_group | ### Instruction:
Does the molecule contain a ether group?
CC(=O)N1CC[C@@H](C(=O)N[C@@H]2CCCC[C@H]2OCCC(C)C)C1
### Response:
Yes |
chain_length | ### Instruction:
What is the length of the longest acyclic carbon chain in the molecule?
O=C([C@@H]1C=C(COc2ccccc2)N=N1)N1CCC(Oc2cccnc2)CC1
### Response:
1 |
canonicalization | ### Instruction:
Canonicalize the following SMILES string.
C(C)c1cc(nc(n1)SCc1ccc(o1)C(N1CCN(CC1)C(=O)C)=O)N(C)C
### Response:
CCc1cc(N(C)C)nc(SCc2ccc(C(=O)N3CCN(C(C)=O)CC3)o2)n1 |
chain_length | ### Instruction:
What is the length of the longest acyclic carbon chain in the molecule?
CC(=O)Nc1ccc(SCCOc2ccccc2C)cc1
### Response:
2 |
functional_group | ### Instruction:
Does the molecule contain a ester group?
C/C(=N\NC(=O)c1ccc(Br)cc1)c1cc(C)oc1C
### Response:
No |
ring_counting | ### Instruction:
Count the six-membered rings in the following molecule.
C[C@H](NC(=O)C1C(C)(C)C1(C)C)c1ccc(Br)cc1
### Response:
1 |
fragment_assembly | ### Instruction:
Assemble these two molecular fragments into a single molecule.
Fragment 1: [14*]c1cccs1
Fragment 2: [4*][C@H]([8*])CN[5*]
### Response:
O=C(NC[C@@H](c1cccs1)N1CCc2ccccc2C1)Nc1ccccc1 |
chain_length | ### Instruction:
What is the length of the longest acyclic carbon chain in the molecule?
Cc1cc(F)ccc1NC(=O)COc1ccc2c(c1)CCC2
### Response:
2 |
functional_group | ### Instruction:
Does the molecule contain a aromatic_ring group?
Cc1ccc(OCCCNC(=O)N2CCC[C@H]2c2c(C)n[nH]c2C)cc1
### Response:
Yes |
ring_counting | ### Instruction:
Count the five-membered rings in the following molecule.
CCC[C@@H](CS)C[NH+](C)Cc1ccncc1
### Response:
0 |
fragment_assembly | ### Instruction:
Assemble these two molecular fragments into a single molecule.
Fragment 1: [1*]C(=O)C[4*]
Fragment 2: [5*]Nc1c(C)n(C)n([9*])c1=O
### Response:
Cc1c(NC(=O)CSc2nc3sc4c(c3c(=O)[nH]2)CCCC4)c(=O)n(-c2ccccc2)n1C |
chain_length | ### Instruction:
What is the length of the longest acyclic carbon chain in the molecule?
C=CCCCN(C)C(=O)NC1CCN(C(=O)c2ccoc2)CC1
### Response:
5 |
functional_group | ### Instruction:
Does the molecule contain a carboxyl group?
Cc1ccc(NC=C2C(=O)N(C)C(=O)N(C)C2=O)cc1
### Response:
No |
functional_group | ### Instruction:
Does the molecule contain a aromatic_ring group?
[NH3+][C@@H]1CCCCC[C@H]1C(=O)NCCC1=CCCCC1
### Response:
No |
fragment_assembly | ### Instruction:
Assemble these two molecular fragments into a single molecule.
Fragment 1: [4*][C@H](C)CN[5*]
Fragment 2: [1*]C(=O)N[5*]
### Response:
CC[NH+](CC)[C@H](C)CNC(=O)Nc1ccc2c(c1)NC(=O)[C@H](C)O2 |
functional_group | ### Instruction:
Does the molecule contain a amide group?
C[C@@H](NC(=O)c1nc(-c2cnccn2)no1)c1ccccc1
### Response:
Yes |
canonicalization | ### Instruction:
Canonicalize the following SMILES string.
C([C@@H]1Sc2c(cccc2)NC1=O)(=O)N1CCC(C(=O)NCCC2=CCCCC2)CC1
### Response:
O=C(NCCC1=CCCCC1)C1CCN(C(=O)[C@@H]2Sc3ccccc3NC2=O)CC1 |
canonicalization | ### Instruction:
Canonicalize the following SMILES string.
c1c(cccc1C(/N=c1/n(c2ccc(cc2s1)S(=O)(=O)N)CCC)=O)N1C(=O)CCC1=O
### Response:
CCCn1/c(=N/C(=O)c2cccc(N3C(=O)CCC3=O)c2)sc2cc(S(N)(=O)=O)ccc21 |
ring_counting | ### Instruction:
Count the five-membered rings in the following molecule.
O=C(c1ccc([N+](=O)[O-])cc1Cl)N1CCOc2ccc(F)cc21
### Response:
0 |
functional_group | ### Instruction:
Does the molecule contain a aromatic_ring group?
CC(C)(C)c1ccc(C(=O)N/C(=C/c2ccc(O)cc2)C(=O)[O-])cc1
### Response:
Yes |
canonicalization | ### Instruction:
Canonicalize the following SMILES string.
c1c(CNC(=O)c2ccc(-n3cccc3)cc2)cnn1Cc1ccccc1
### Response:
O=C(NCc1cnn(Cc2ccccc2)c1)c1ccc(-n2cccc2)cc1 |
canonicalization | ### Instruction:
Canonicalize the following SMILES string.
C1CN(S(=O)(=O)N(C1)Cc1c(cccc1)C)Cc1ccccc1Cl
### Response:
Cc1ccccc1CN1CCCN(Cc2ccccc2Cl)S1(=O)=O |
fragment_assembly | ### Instruction:
Assemble these two molecular fragments into a single molecule.
Fragment 1: [3*]Oc1cccc(C#N)c1
Fragment 2: [1*]C(=O)[C@H](C)O[3*]
### Response:
C[C@H](Oc1cccc(C#N)c1)C(=O)NC[C@]1(N2CCOCC2)CCSC1 |
fragment_assembly | ### Instruction:
Assemble these two molecular fragments into a single molecule.
Fragment 1: [16*]c1ccc(F)cc1
Fragment 2: [5*]N1CCN([5*])CC1
### Response:
O=C([C@H]1CCCN(c2nc(Cl)nc3[nH]cnc23)C1)N1CCN(c2ccc(F)cc2)CC1 |
fragment_assembly | ### Instruction:
Assemble these two molecular fragments into a single molecule.
Fragment 1: [9*]n1ccnc1S[11*]
Fragment 2: [16*]c1ccccc1
### Response:
O=C1CCCC[C@@H]1Sc1nccn1-c1ccccc1 |
fragment_assembly | ### Instruction:
Assemble these two molecular fragments into a single molecule.
Fragment 1: [1*]C(=O)C[4*]
Fragment 2: [5*]N(C)C(C)C
### Response:
CC(C)N(C)C(=O)CSc1nncs1 |
chain_length | ### Instruction:
What is the length of the longest acyclic carbon chain in the molecule?
CCc1c(OC)nc2nc(C(=O)c3ccccc3)cn2c1C
### Response:
2 |
canonicalization | ### Instruction:
Canonicalize the following SMILES string.
O=C(N1[C@@H](CCC1)c1c(C)n[nH]c1C)c1cc(C)ccc1O
### Response:
Cc1ccc(O)c(C(=O)N2CCC[C@H]2c2c(C)n[nH]c2C)c1 |
chain_length | ### Instruction:
What is the length of the longest acyclic carbon chain in the molecule?
COC[C@H](NC(=O)N1CCN([C@H](C)C(=O)N2CCCC2)CC1)c1ccco1
### Response:
3 |
ring_counting | ### Instruction:
Count the five-membered rings in the following molecule.
C[C@@H]1Cc2ccccc2N1CCC(=O)N(C)CCC(N)=S
### Response:
1 |
fragment_assembly | ### Instruction:
Assemble these two molecular fragments into a single molecule.
Fragment 1: [8*]CC(=O)OC
Fragment 2: [5*]Nc1nc([14*])n[n-]1
### Response:
COC(=O)Cc1n[n-]c(NC(=O)c2nc(C3CC3)n3ccccc23)n1 |
canonicalization | ### Instruction:
Canonicalize the following SMILES string.
c1cnc2n(Cc3ccc(Cl)cc3)c(=O)c(cc2c1)C(=O)NCc1sccc1
### Response:
O=C(NCc1cccs1)c1cc2cccnc2n(Cc2ccc(Cl)cc2)c1=O |
ring_counting | ### Instruction:
Count the six-membered rings in the following molecule.
Cc1nc(C(C)(C)c2ccccc2)sc1C(=O)Nc1ccnn1C(C)C
### Response:
1 |
canonicalization | ### Instruction:
Canonicalize the following SMILES string.
C1C[NH+](CCN1Cc1ccc(cc1)C(=O)N[C@H]1[C@H](C1)C)C
### Response:
C[C@H]1C[C@H]1NC(=O)c1ccc(CN2CC[NH+](C)CC2)cc1 |
canonicalization | ### Instruction:
Canonicalize the following SMILES string.
O1CCN(C[C@H]1c1ccc(C)cc1C)CC(=O)N1CCC[C@@H](C1)C
### Response:
Cc1ccc([C@@H]2CN(CC(=O)N3CCC[C@H](C)C3)CCO2)c(C)c1 |
functional_group | ### Instruction:
Does the molecule contain a sulfonyl group?
COc1cc(SC)ccc1C(=O)Nc1nc2c(C)cccc2s1
### Response:
No |
canonicalization | ### Instruction:
Canonicalize the following SMILES string.
N(c1nnc(C)c(C)c1C#N)CCC(=O)N1C[C@@H](O[C@H](C1)C)C
### Response:
Cc1nnc(NCCC(=O)N2C[C@H](C)O[C@@H](C)C2)c(C#N)c1C |
fragment_assembly | ### Instruction:
Assemble these two molecular fragments into a single molecule.
Fragment 1: [4*]CCC
Fragment 2: [15*]C1CCCC1
### Response:
CCCN(C(=O)NC1CCCC1)C1(C[NH3+])CCCC1 |
ring_counting | ### Instruction:
Count the six-membered rings in the following molecule.
O=C(NC[C@@H](c1cccs1)S(=O)(=O)c1ccc(F)cc1)c1ccc(Cl)cc1
### Response:
2 |
chain_length | ### Instruction:
What is the length of the longest acyclic carbon chain in the molecule?
Cc1ccc(S(=O)(=O)N(CC(=O)N2CCN(C=O)CC2)c2ccccc2F)cc1
### Response:
2 |
fragment_assembly | ### Instruction:
Assemble these two molecular fragments into a single molecule.
Fragment 1: [5*][NH+]([5*])C1CCC(C)CC1
Fragment 2: [5*]N(C)C
### Response:
CC1CCC([NH+](Cc2nc(N)nc(N(C)C)n2)C2CC2)CC1 |
fragment_assembly | ### Instruction:
Assemble these two molecular fragments into a single molecule.
Fragment 1: [1*]C(=O)c1cccs1
Fragment 2: [16*]c1cc(OC)ccc1OC
### Response:
COc1ccc(OC)c(-c2nnc(NC(=O)c3cccs3)o2)c1 |
chain_length | ### Instruction:
What is the length of the longest acyclic carbon chain in the molecule?
CCN(Cc1cc(-c2ccccc2)[nH]n1)C[C@H](C)C#N
### Response:
3 |
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