prompt
stringlengths
120
209
completion
stringlengths
15
103
input_smiles
stringlengths
14
103
output_smiles
stringlengths
15
103
task_id
int64
102
102
winner_action
dict
Can you make molecule COC(=O)[C@@H]1CCC[C@@H]1NC(=O)Nc1ccc(-c2csc(C)n2)cc1 less soluble in water? The output molecule should be similar to the input molecule.
COSC(=O)C[C@@H]1CCC[C@@H]1NC(=O)Nc1ccc(-c2csc(C)n2)cc1
COC(=O)[C@@H]1CCC[C@@H]1NC(=O)Nc1ccc(-c2csc(C)n2)cc1
COSC(=O)C[C@@H]1CCC[C@@H]1NC(=O)Nc1ccc(-c2csc(C)n2)cc1
102
{ "fragment_index": 0, "new_substring": "S&C(=O)C&", "old_substring": "C38=O" }
Can you make molecule COC(=O)[C@@H]1CCC[C@@H]1NC(=O)Nc1ccc(-c2csc(C)n2)cc1 less soluble in water? The output molecule should be similar to the input molecule.
COCC(=C=O)C[C@@H]1CCC[C@@H]1NC(=O)Nc1ccc(-c2csc(C)n2)cc1
COC(=O)[C@@H]1CCC[C@@H]1NC(=O)Nc1ccc(-c2csc(C)n2)cc1
COCC(=C=O)C[C@@H]1CCC[C@@H]1NC(=O)Nc1ccc(-c2csc(C)n2)cc1
102
{ "fragment_index": 0, "new_substring": "C&C(=C=O)C&", "old_substring": "C38=O" }
Can you make molecule COC(=O)[C@@H]1CCC[C@@H]1NC(=O)Nc1ccc(-c2csc(C)n2)cc1 less soluble in water? The output molecule should be similar to the input molecule.
COC(=O)CCCC(=O)[C@@H]1CCC[C@@H]1NC(=O)Nc1ccc(-c2csc(C)n2)cc1
COC(=O)[C@@H]1CCC[C@@H]1NC(=O)Nc1ccc(-c2csc(C)n2)cc1
COC(=O)CCCC(=O)[C@@H]1CCC[C@@H]1NC(=O)Nc1ccc(-c2csc(C)n2)cc1
102
{ "fragment_index": 0, "new_substring": "C&(=O)CCCC&=O", "old_substring": "C38=O" }
Can you make molecule COC(=O)[C@@H]1CCC[C@@H]1NC(=O)Nc1ccc(-c2csc(C)n2)cc1 less soluble in water? The output molecule should be similar to the input molecule.
COC(=O)CC(C)(C)[C@@H]1CCC[C@@H]1NC(=O)Nc1ccc(-c2csc(C)n2)cc1
COC(=O)[C@@H]1CCC[C@@H]1NC(=O)Nc1ccc(-c2csc(C)n2)cc1
COC(=O)CC(C)(C)[C@@H]1CCC[C@@H]1NC(=O)Nc1ccc(-c2csc(C)n2)cc1
102
{ "fragment_index": 0, "new_substring": "C&(=O)CC&(C)C", "old_substring": "C38=O" }
Can you make molecule COC(=O)[C@@H]1CCC[C@@H]1NC(=O)Nc1ccc(-c2csc(C)n2)cc1 less soluble in water? The output molecule should be similar to the input molecule.
COC[S@+]([O-])CCC[C@@H]1CCC[C@@H]1NC(=O)Nc1ccc(-c2csc(C)n2)cc1
COC(=O)[C@@H]1CCC[C@@H]1NC(=O)Nc1ccc(-c2csc(C)n2)cc1
COC[S@+]([O-])CCC[C@@H]1CCC[C@@H]1NC(=O)Nc1ccc(-c2csc(C)n2)cc1
102
{ "fragment_index": 0, "new_substring": "C&[S@](=O)CCC&", "old_substring": "C38=O" }
Can you make molecule CN(C(=O)c1ccn(-c2ccccc2F)n1)C1(C#N)CCC1 less soluble in water? The output molecule should be similar to the input molecule.
N#CC1(N2CCC(C(=O)c3ccn(-c4ccccc4F)n3)CC2)CCC1
CN(C(=O)c1ccn(-c2ccccc2F)n1)C1(C#N)CCC1
N#CC1(N2CCC(C(=O)c3ccn(-c4ccccc4F)n3)CC2)CCC1
102
{ "fragment_index": 0, "new_substring": "C1&CCN&CC1", "old_substring": "CN34" }
Can you make molecule CN(C(=O)c1ccn(-c2ccccc2F)n1)C1(C#N)CCC1 less soluble in water? The output molecule should be similar to the input molecule.
CN(C(=O)c1ccn(-c2ccccc2F)n1)C(=S)SC1(C#N)CCC1
CN(C(=O)c1ccn(-c2ccccc2F)n1)C1(C#N)CCC1
CN(C(=O)c1ccn(-c2ccccc2F)n1)C(=S)SC1(C#N)CCC1
102
{ "fragment_index": 0, "new_substring": "CN&C(=S)S&", "old_substring": "CN34" }
Can you make molecule CN(C(=O)c1ccn(-c2ccccc2F)n1)C1(C#N)CCC1 less soluble in water? The output molecule should be similar to the input molecule.
N#CC1(C2CCN(CC(=O)c3ccn(-c4ccccc4F)n3)CC2)CCC1
CN(C(=O)c1ccn(-c2ccccc2F)n1)C1(C#N)CCC1
N#CC1(C2CCN(CC(=O)c3ccn(-c4ccccc4F)n3)CC2)CCC1
102
{ "fragment_index": 0, "new_substring": "C&N1CCC&CC1", "old_substring": "CN34" }
Can you make molecule CN(C(=O)c1ccn(-c2ccccc2F)n1)C1(C#N)CCC1 less soluble in water? The output molecule should be similar to the input molecule.
N#CC1(N2CN(C(=O)c3ccn(-c4ccccc4F)n3)CSC2=S)CCC1
CN(C(=O)c1ccn(-c2ccccc2F)n1)C1(C#N)CCC1
N#CC1(N2CN(C(=O)c3ccn(-c4ccccc4F)n3)CSC2=S)CCC1
102
{ "fragment_index": 0, "new_substring": "S=C1SCN&CN1&", "old_substring": "CN34" }
Can you make molecule CN(C(=O)c1ccn(-c2ccccc2F)n1)C1(C#N)CCC1 less soluble in water? The output molecule should be similar to the input molecule.
N#CC1(C(=O)c2ccn(-c3ccccc3F)n2)CCC(C2(C#N)CCC2)CC1
CN(C(=O)c1ccn(-c2ccccc2F)n1)C1(C#N)CCC1
N#CC1(C(=O)c2ccn(-c3ccccc3F)n2)CCC(C2(C#N)CCC2)CC1
102
{ "fragment_index": 0, "new_substring": "C1&(C#N)CCC&CC1", "old_substring": "CN34" }
Can you make molecule Cc1ocnc1CNC(=O)N[C@H]1CCN(C(=O)c2ccccc2)C1 less soluble in water? The output molecule should be similar to the input molecule.
Cc1ocnc1CNC(=O)CC(C)(C)N[C@H]1CCN(C(=O)c2ccccc2)C1
Cc1ocnc1CNC(=O)N[C@H]1CCN(C(=O)c2ccccc2)C1
Cc1ocnc1CNC(=O)CC(C)(C)N[C@H]1CCN(C(=O)c2ccccc2)C1
102
{ "fragment_index": 0, "new_substring": "C&(=O)CC&(C)C", "old_substring": "C34=O" }
Can you make molecule Cc1ocnc1CNC(=O)N[C@H]1CCN(C(=O)c2ccccc2)C1 less soluble in water? The output molecule should be similar to the input molecule.
Cc1ocnc1CNC(=O)CCC(C)(C)N[C@H]1CCN(C(=O)c2ccccc2)C1
Cc1ocnc1CNC(=O)N[C@H]1CCN(C(=O)c2ccccc2)C1
Cc1ocnc1CNC(=O)CCC(C)(C)N[C@H]1CCN(C(=O)c2ccccc2)C1
102
{ "fragment_index": 0, "new_substring": "C&(=O)CCC&(C)C", "old_substring": "C34=O" }
Can you make molecule Cc1ocnc1CNC(=O)N[C@H]1CCN(C(=O)c2ccccc2)C1 less soluble in water? The output molecule should be similar to the input molecule.
Cc1ocnc1CNc1c(C)n(C)n(N[C@H]2CCN(C(=O)c3ccccc3)C2)c1=O
Cc1ocnc1CNC(=O)N[C@H]1CCN(C(=O)c2ccccc2)C1
Cc1ocnc1CNc1c(C)n(C)n(N[C@H]2CCN(C(=O)c3ccccc3)C2)c1=O
102
{ "fragment_index": 0, "new_substring": "Cc1c&c(=O)n&n1C", "old_substring": "C34=O" }
Can you make molecule Cc1ocnc1CNC(=O)N[C@H]1CCN(C(=O)c2ccccc2)C1 less soluble in water? The output molecule should be similar to the input molecule.
Cc1ocnc1CNc1nn(N[C@H]2CCN(C(=O)c3ccccc3)C2)c(C)cc1=O
Cc1ocnc1CNC(=O)N[C@H]1CCN(C(=O)c2ccccc2)C1
Cc1ocnc1CNc1nn(N[C@H]2CCN(C(=O)c3ccccc3)C2)c(C)cc1=O
102
{ "fragment_index": 0, "new_substring": "Cc1cc(=O)c&nn1&", "old_substring": "C34=O" }
Can you make molecule Cc1ocnc1CNC(=O)N[C@H]1CCN(C(=O)c2ccccc2)C1 less soluble in water? The output molecule should be similar to the input molecule.
Cc1ocnc1CNC(=O)C[C@@H](Br)N[C@H]1CCN(C(=O)c2ccccc2)C1
Cc1ocnc1CNC(=O)N[C@H]1CCN(C(=O)c2ccccc2)C1
Cc1ocnc1CNC(=O)C[C@@H](Br)N[C@H]1CCN(C(=O)c2ccccc2)C1
102
{ "fragment_index": 0, "new_substring": "C&(=O)C[C@H]&Br", "old_substring": "C34=O" }
Can you make molecule CCc1csc([C@H]2CCC[NH+](CC(=O)N(C)OC)C2)n1 less soluble in water? The output molecule should be similar to the input molecule.
CCc1csc([C@H]2CCC[NH+](CC(=O)N(C)OC)C2)c1
CCc1csc([C@H]2CCC[NH+](CC(=O)N(C)OC)C2)n1
CCc1csc([C@H]2CCC[NH+](CC(=O)N(C)OC)C2)c1
102
{ "fragment_index": 0, "new_substring": "c1&csc&c1", "old_substring": "c14csc5n1" }
Can you make molecule CCc1csc([C@H]2CCC[NH+](CC(=O)N(C)OC)C2)n1 less soluble in water? The output molecule should be similar to the input molecule.
CCc1csc([C@H]2CCC[NH+](CC(=O)N(C)OC)C2)c1C
CCc1csc([C@H]2CCC[NH+](CC(=O)N(C)OC)C2)n1
CCc1csc([C@H]2CCC[NH+](CC(=O)N(C)OC)C2)c1C
102
{ "fragment_index": 0, "new_substring": "c1&csc&c1C", "old_substring": "c14csc5n1" }
Can you make molecule CCc1csc([C@H]2CCC[NH+](CC(=O)N(C)OC)C2)n1 less soluble in water? The output molecule should be similar to the input molecule.
CCc1ccc([C@H]2CCC[NH+](CC(=O)N(C)OC)C2)s1
CCc1csc([C@H]2CCC[NH+](CC(=O)N(C)OC)C2)n1
CCc1ccc([C@H]2CCC[NH+](CC(=O)N(C)OC)C2)s1
102
{ "fragment_index": 0, "new_substring": "c1&ccc&s1", "old_substring": "c14csc5n1" }
Can you make molecule CCc1csc([C@H]2CCC[NH+](CC(=O)N(C)OC)C2)n1 less soluble in water? The output molecule should be similar to the input molecule.
CCc1cc([C@H]2CCC[NH+](CC(=O)N(C)OC)C2)cnc1Cl
CCc1csc([C@H]2CCC[NH+](CC(=O)N(C)OC)C2)n1
CCc1cc([C@H]2CCC[NH+](CC(=O)N(C)OC)C2)cnc1Cl
102
{ "fragment_index": 0, "new_substring": "c1&cc&cnc1Cl", "old_substring": "c14csc5n1" }
Can you make molecule CCc1csc([C@H]2CCC[NH+](CC(=O)N(C)OC)C2)n1 less soluble in water? The output molecule should be similar to the input molecule.
CCc1cc([C@H]2CCC[NH+](CC(=O)N(C)OC)C2)ncc1Cl
CCc1csc([C@H]2CCC[NH+](CC(=O)N(C)OC)C2)n1
CCc1cc([C@H]2CCC[NH+](CC(=O)N(C)OC)C2)ncc1Cl
102
{ "fragment_index": 0, "new_substring": "c1&cc&ncc1Cl", "old_substring": "c14csc5n1" }
Can you make molecule O=C(c1ccn(-c2cccc([N+](=O)[O-])c2)n1)N(CCO)Cc1ccccc1 less soluble in water? The output molecule should be similar to the input molecule.
O=C(c1ccn(-c2cccc([N+](=O)[O-])c2)c1)N(CCO)Cc1ccccc1
O=C(c1ccn(-c2cccc([N+](=O)[O-])c2)n1)N(CCO)Cc1ccccc1
O=C(c1ccn(-c2cccc([N+](=O)[O-])c2)c1)N(CCO)Cc1ccccc1
102
{ "fragment_index": 0, "new_substring": "c1&ccn&c1", "old_substring": "c16ccn8n1" }
Can you make molecule O=C(c1ccn(-c2cccc([N+](=O)[O-])c2)n1)N(CCO)Cc1ccccc1 less soluble in water? The output molecule should be similar to the input molecule.
O=C(c1csc2nc(-c3cccc([N+](=O)[O-])c3)cn12)N(CCO)Cc1ccccc1
O=C(c1ccn(-c2cccc([N+](=O)[O-])c2)n1)N(CCO)Cc1ccccc1
O=C(c1csc2nc(-c3cccc([N+](=O)[O-])c3)cn12)N(CCO)Cc1ccccc1
102
{ "fragment_index": 0, "new_substring": "c1&csc2nc&cn12", "old_substring": "c16ccn8n1" }
Can you make molecule O=C(c1ccn(-c2cccc([N+](=O)[O-])c2)n1)N(CCO)Cc1ccccc1 less soluble in water? The output molecule should be similar to the input molecule.
O=C(c1cc(-c2cccc([N+](=O)[O-])c2)nc(Cl)n1)N(CCO)Cc1ccccc1
O=C(c1ccn(-c2cccc([N+](=O)[O-])c2)n1)N(CCO)Cc1ccccc1
O=C(c1cc(-c2cccc([N+](=O)[O-])c2)nc(Cl)n1)N(CCO)Cc1ccccc1
102
{ "fragment_index": 0, "new_substring": "c1&cc&nc(Cl)n1", "old_substring": "c16ccn8n1" }
Can you make molecule O=C(c1ccn(-c2cccc([N+](=O)[O-])c2)n1)N(CCO)Cc1ccccc1 less soluble in water? The output molecule should be similar to the input molecule.
O=C(c1cc(Cl)nc(-c2cccc([N+](=O)[O-])c2)n1)N(CCO)Cc1ccccc1
O=C(c1ccn(-c2cccc([N+](=O)[O-])c2)n1)N(CCO)Cc1ccccc1
O=C(c1cc(Cl)nc(-c2cccc([N+](=O)[O-])c2)n1)N(CCO)Cc1ccccc1
102
{ "fragment_index": 0, "new_substring": "c1&cc(Cl)nc&n1", "old_substring": "c16ccn8n1" }
Can you make molecule O=C(c1ccn(-c2cccc([N+](=O)[O-])c2)n1)N(CCO)Cc1ccccc1 less soluble in water? The output molecule should be similar to the input molecule.
Cn1nc(-c2cccc([N+](=O)[O-])c2)c(Br)c1C(=O)N(CCO)Cc1ccccc1
O=C(c1ccn(-c2cccc([N+](=O)[O-])c2)n1)N(CCO)Cc1ccccc1
Cn1nc(-c2cccc([N+](=O)[O-])c2)c(Br)c1C(=O)N(CCO)Cc1ccccc1
102
{ "fragment_index": 0, "new_substring": "c1&c(Br)c&nn1C", "old_substring": "c16ccn8n1" }
Can you make molecule CCn1ccnc(NC2CCN(c3ccc(C)c[nH+]3)CC2)c1=O less soluble in water? The output molecule should be similar to the input molecule.
C=CSn1ccnc(NC2CCN(c3ccc(C)c[nH+]3)CC2)c1=O
CCn1ccnc(NC2CCN(c3ccc(C)c[nH+]3)CC2)c1=O
C=CSn1ccnc(NC2CCN(c3ccc(C)c[nH+]3)CC2)c1=O
102
{ "fragment_index": 0, "new_substring": "C=CS&", "old_substring": "CC7" }
Can you make molecule CCn1ccnc(NC2CCN(c3ccc(C)c[nH+]3)CC2)c1=O less soluble in water? The output molecule should be similar to the input molecule.
Cc1ccc(N2CCC(Nc3nccn(C(C)C)c3=O)CC2)[nH+]c1
CCn1ccnc(NC2CCN(c3ccc(C)c[nH+]3)CC2)c1=O
Cc1ccc(N2CCC(Nc3nccn(C(C)C)c3=O)CC2)[nH+]c1
102
{ "fragment_index": 0, "new_substring": "C&(C)C", "old_substring": "CC7" }
Can you make molecule CCn1ccnc(NC2CCN(c3ccc(C)c[nH+]3)CC2)c1=O less soluble in water? The output molecule should be similar to the input molecule.
C=CCCn1ccnc(NC2CCN(c3ccc(C)c[nH+]3)CC2)c1=O
CCn1ccnc(NC2CCN(c3ccc(C)c[nH+]3)CC2)c1=O
C=CCCn1ccnc(NC2CCN(c3ccc(C)c[nH+]3)CC2)c1=O
102
{ "fragment_index": 0, "new_substring": "C=CCC&", "old_substring": "CC7" }
Can you make molecule CCn1ccnc(NC2CCN(c3ccc(C)c[nH+]3)CC2)c1=O less soluble in water? The output molecule should be similar to the input molecule.
Cc1ccc(N2CCC(Nc3nccn(CCCCl)c3=O)CC2)[nH+]c1
CCn1ccnc(NC2CCN(c3ccc(C)c[nH+]3)CC2)c1=O
Cc1ccc(N2CCC(Nc3nccn(CCCCl)c3=O)CC2)[nH+]c1
102
{ "fragment_index": 0, "new_substring": "C&CCCl", "old_substring": "CC7" }
Can you make molecule CCn1ccnc(NC2CCN(c3ccc(C)c[nH+]3)CC2)c1=O less soluble in water? The output molecule should be similar to the input molecule.
Cc1ccc(N2CCC(Nc3nccn(CCCCS)c3=O)CC2)[nH+]c1
CCn1ccnc(NC2CCN(c3ccc(C)c[nH+]3)CC2)c1=O
Cc1ccc(N2CCC(Nc3nccn(CCCCS)c3=O)CC2)[nH+]c1
102
{ "fragment_index": 0, "new_substring": "C&CCCS", "old_substring": "CC7" }
Can you make molecule COc1ccc(C(=O)N2CCN(C(=O)c3cc(-c4ccc(C)c(C)c4)n[nH]3)CC2)cc1OC less soluble in water? The output molecule should be similar to the input molecule.
COc1ccc(C(=O)N2CCN(C(=O)c3ncc(C)[nH]3)CC2)cc1OC.Cc1ccccc1C
COc1ccc(C(=O)N2CCN(C(=O)c3cc(-c4ccc(C)c(C)c4)n[nH]3)CC2)cc1OC
COc1ccc(C(=O)N2CCN(C(=O)c3ncc(C)[nH]3)CC2)cc1OC.Cc1ccccc1C
102
{ "fragment_index": 0, "new_substring": "c1&nc&c(C)[nH]1", "old_substring": "c19cc%11n[nH]1" }
Can you make molecule COc1ccc(C(=O)N2CCN(C(=O)c3cc(-c4ccc(C)c(C)c4)n[nH]3)CC2)cc1OC less soluble in water? The output molecule should be similar to the input molecule.
COc1ccc(C(=O)N2CCN(C(=O)c3nc(C)c[nH]3)CC2)cc1OC.Cc1ccccc1C
COc1ccc(C(=O)N2CCN(C(=O)c3cc(-c4ccc(C)c(C)c4)n[nH]3)CC2)cc1OC
COc1ccc(C(=O)N2CCN(C(=O)c3nc(C)c[nH]3)CC2)cc1OC.Cc1ccccc1C
102
{ "fragment_index": 0, "new_substring": "c1&nc(C)c&[nH]1", "old_substring": "c19cc%11n[nH]1" }
Can you make molecule COc1ccc(C(=O)N2CCN(C(=O)c3cc(-c4ccc(C)c(C)c4)n[nH]3)CC2)cc1OC less soluble in water? The output molecule should be similar to the input molecule.
COc1ccc(C(=O)N2CCN(C(=O)c3ccc4nc[nH]c4c3)CC2)cc1OC.Cc1ccccc1C
COc1ccc(C(=O)N2CCN(C(=O)c3cc(-c4ccc(C)c(C)c4)n[nH]3)CC2)cc1OC
COc1ccc(C(=O)N2CCN(C(=O)c3ccc4nc[nH]c4c3)CC2)cc1OC.Cc1ccccc1C
102
{ "fragment_index": 0, "new_substring": "c1&ccc2nc&[nH]c2c1", "old_substring": "c19cc%11n[nH]1" }
Can you make molecule COc1ccc(C(=O)N2CCN(C(=O)c3cc(-c4ccc(C)c(C)c4)n[nH]3)CC2)cc1OC less soluble in water? The output molecule should be similar to the input molecule.
COc1ccc(C(=O)N2CCN(C(=O)c3ccc4cn[nH]c4n3)CC2)cc1OC.Cc1ccccc1C
COc1ccc(C(=O)N2CCN(C(=O)c3cc(-c4ccc(C)c(C)c4)n[nH]3)CC2)cc1OC
COc1ccc(C(=O)N2CCN(C(=O)c3ccc4cn[nH]c4n3)CC2)cc1OC.Cc1ccccc1C
102
{ "fragment_index": 0, "new_substring": "c1&ccc2c&n[nH]c2n1", "old_substring": "c19cc%11n[nH]1" }
Can you make molecule COc1ccc(C(=O)N2CCN(C(=O)c3cc(-c4ccc(C)c(C)c4)n[nH]3)CC2)cc1OC less soluble in water? The output molecule should be similar to the input molecule.
COc1ccc(C(=O)N2CCN(C(=O)c3cc4cccnc4[nH]3)CC2)cc1OC.Cc1ccccc1C
COc1ccc(C(=O)N2CCN(C(=O)c3cc(-c4ccc(C)c(C)c4)n[nH]3)CC2)cc1OC
COc1ccc(C(=O)N2CCN(C(=O)c3cc4cccnc4[nH]3)CC2)cc1OC.Cc1ccccc1C
102
{ "fragment_index": 0, "new_substring": "c1&cc2cc&cnc2[nH]1", "old_substring": "c19cc%11n[nH]1" }
Can you make molecule COc1cc(S(=O)(=O)CCC(C)C)cc(C(=O)[O-])c1OC less soluble in water? The output molecule should be similar to the input molecule.
COCc1cc(S(=O)(=O)CCC(C)C)cc(C(=O)[O-])c1OC
COc1cc(S(=O)(=O)CCC(C)C)cc(C(=O)[O-])c1OC
COCc1cc(S(=O)(=O)CCC(C)C)cc(C(=O)[O-])c1OC
102
{ "fragment_index": 0, "new_substring": "COC&", "old_substring": "CO2" }
Can you make molecule COc1cc(S(=O)(=O)CCC(C)C)cc(C(=O)[O-])c1OC less soluble in water? The output molecule should be similar to the input molecule.
COc1c(C(=O)[O-])cc(S(=O)(=O)CCC(C)C)cc1C1OCc2ccccc2CO1
COc1cc(S(=O)(=O)CCC(C)C)cc(C(=O)[O-])c1OC
COc1c(C(=O)[O-])cc(S(=O)(=O)CCC(C)C)cc1C1OCc2ccccc2CO1
102
{ "fragment_index": 0, "new_substring": "C1&OCc2ccccc2CO1", "old_substring": "CO2" }
Can you make molecule COc1cc(S(=O)(=O)CCC(C)C)cc(C(=O)[O-])c1OC less soluble in water? The output molecule should be similar to the input molecule.
COc1c(C(=O)[O-])cc(S(=O)(=O)CCC(C)C)cc1C1(O)Cc2ccccc2C1
COc1cc(S(=O)(=O)CCC(C)C)cc(C(=O)[O-])c1OC
COc1c(C(=O)[O-])cc(S(=O)(=O)CCC(C)C)cc1C1(O)Cc2ccccc2C1
102
{ "fragment_index": 0, "new_substring": "C1&(O)Cc2ccccc2C1", "old_substring": "CO2" }
Can you make molecule COc1cc(S(=O)(=O)CCC(C)C)cc(C(=O)[O-])c1OC less soluble in water? The output molecule should be similar to the input molecule.
COc1c(C(=O)[O-])cc(S(=O)(=O)CCC(C)C)cc1C1=CC2=NN2C[C@@H](C)CO1
COc1cc(S(=O)(=O)CCC(C)C)cc(C(=O)[O-])c1OC
COc1c(C(=O)[O-])cc(S(=O)(=O)CCC(C)C)cc1C1=CC2=NN2C[C@@H](C)CO1
102
{ "fragment_index": 0, "new_substring": "C[C@H]1COc2cc&nn2C1", "old_substring": "CO2" }
Can you make molecule COc1cc(S(=O)(=O)CCC(C)C)cc(C(=O)[O-])c1OC less soluble in water? The output molecule should be similar to the input molecule.
COc1c(C(=O)[O-])cc(S(=O)(=O)CCC(C)C)cc1N1CCOc2ccccc21
COc1cc(S(=O)(=O)CCC(C)C)cc(C(=O)[O-])c1OC
COc1c(C(=O)[O-])cc(S(=O)(=O)CCC(C)C)cc1N1CCOc2ccccc21
102
{ "fragment_index": 0, "new_substring": "N1&CCOc2ccccc21", "old_substring": "CO2" }
Can you make molecule CC(C)n1ncc2cc(NC(=O)CCc3ccccc3)cnc21 less soluble in water? The output molecule should be similar to the input molecule.
O=C(CCc1ccccc1)Nc1cnc2c(cnn2CCCCBr)c1
CC(C)n1ncc2cc(NC(=O)CCc3ccccc3)cnc21
O=C(CCc1ccccc1)Nc1cnc2c(cnn2CCCCBr)c1
102
{ "fragment_index": 0, "new_substring": "C&CCCBr", "old_substring": "CC6C" }
Can you make molecule CC(C)n1ncc2cc(NC(=O)CCc3ccccc3)cnc21 less soluble in water? The output molecule should be similar to the input molecule.
C=CCCCCn1ncc2cc(NC(=O)CCc3ccccc3)cnc21
CC(C)n1ncc2cc(NC(=O)CCc3ccccc3)cnc21
C=CCCCCn1ncc2cc(NC(=O)CCc3ccccc3)cnc21
102
{ "fragment_index": 0, "new_substring": "C=CCCCC&", "old_substring": "CC6C" }
Can you make molecule CC(C)n1ncc2cc(NC(=O)CCc3ccccc3)cnc21 less soluble in water? The output molecule should be similar to the input molecule.
O=C(CCc1ccccc1)Nc1cnc2c(cnn2CCCCCBr)c1
CC(C)n1ncc2cc(NC(=O)CCc3ccccc3)cnc21
O=C(CCc1ccccc1)Nc1cnc2c(cnn2CCCCCBr)c1
102
{ "fragment_index": 0, "new_substring": "C&CCCCBr", "old_substring": "CC6C" }
Can you make molecule CC(C)n1ncc2cc(NC(=O)CCc3ccccc3)cnc21 less soluble in water? The output molecule should be similar to the input molecule.
O=C(CCc1ccccc1)Nc1cnc2c(cnn2CCCCCS)c1
CC(C)n1ncc2cc(NC(=O)CCc3ccccc3)cnc21
O=C(CCc1ccccc1)Nc1cnc2c(cnn2CCCCCS)c1
102
{ "fragment_index": 0, "new_substring": "SCCCCC&", "old_substring": "CC6C" }
Can you make molecule CC(C)n1ncc2cc(NC(=O)CCc3ccccc3)cnc21 less soluble in water? The output molecule should be similar to the input molecule.
O=C(CCc1ccccc1)Nc1cnc2c(cnn2CCCCCCS)c1
CC(C)n1ncc2cc(NC(=O)CCc3ccccc3)cnc21
O=C(CCc1ccccc1)Nc1cnc2c(cnn2CCCCCCS)c1
102
{ "fragment_index": 0, "new_substring": "SCCCCCC&", "old_substring": "CC6C" }
Can you make molecule CCOC(=O)c1cc(C)sc1NC(=O)Cn1c(=O)oc2ccccc21 less soluble in water? The output molecule should be similar to the input molecule.
CCOC(=O)c1cc(Cl)c(NC(=O)Cn2c(=O)oc3ccccc32)cc1Cl
CCOC(=O)c1cc(C)sc1NC(=O)Cn1c(=O)oc2ccccc21
CCOC(=O)c1cc(Cl)c(NC(=O)Cn2c(=O)oc3ccccc32)cc1Cl
102
{ "fragment_index": 0, "new_substring": "c1&cc(Cl)c&cc1Cl", "old_substring": "c17cc(C)sc16" }
Can you make molecule CCOC(=O)c1cc(C)sc1NC(=O)Cn1c(=O)oc2ccccc21 less soluble in water? The output molecule should be similar to the input molecule.
CCOC(=O)c1cc(NC(=O)Cn2c(=O)oc3ccccc32)sc1Br
CCOC(=O)c1cc(C)sc1NC(=O)Cn1c(=O)oc2ccccc21
CCOC(=O)c1cc(NC(=O)Cn2c(=O)oc3ccccc32)sc1Br
102
{ "fragment_index": 0, "new_substring": "c1&cc&sc1Br", "old_substring": "c17cc(C)sc16" }
Can you make molecule CCOC(=O)c1cc(C)sc1NC(=O)Cn1c(=O)oc2ccccc21 less soluble in water? The output molecule should be similar to the input molecule.
CCOC(=O)c1cc(Br)c(NC(=O)Cn2c(=O)oc3ccccc32)cc1C
CCOC(=O)c1cc(C)sc1NC(=O)Cn1c(=O)oc2ccccc21
CCOC(=O)c1cc(Br)c(NC(=O)Cn2c(=O)oc3ccccc32)cc1C
102
{ "fragment_index": 0, "new_substring": "c1&cc(Br)c&cc1C", "old_substring": "c17cc(C)sc16" }
Can you make molecule CCOC(=O)c1cc(C)sc1NC(=O)Cn1c(=O)oc2ccccc21 less soluble in water? The output molecule should be similar to the input molecule.
CCOC(=O)c1ccc2sc(NC(=O)Cn3c(=O)oc4ccccc43)c(C)c2c1
CCOC(=O)c1cc(C)sc1NC(=O)Cn1c(=O)oc2ccccc21
CCOC(=O)c1ccc2sc(NC(=O)Cn3c(=O)oc4ccccc43)c(C)c2c1
102
{ "fragment_index": 0, "new_substring": "c1&ccc2sc&c(C)c2c1", "old_substring": "c17cc(C)sc16" }
Can you make molecule CCOC(=O)c1cc(C)sc1NC(=O)Cn1c(=O)oc2ccccc21 less soluble in water? The output molecule should be similar to the input molecule.
CCOC(=O)c1cc(NC(=O)Cn2c(=O)oc3ccccc32)cc(C)c1I
CCOC(=O)c1cc(C)sc1NC(=O)Cn1c(=O)oc2ccccc21
CCOC(=O)c1cc(NC(=O)Cn2c(=O)oc3ccccc32)cc(C)c1I
102
{ "fragment_index": 0, "new_substring": "c1&cc&cc(C)c1I", "old_substring": "c17cc(C)sc16" }
Can you make molecule C[NH2+]CC[C@@H](Sc1ccccn1)c1ccccc1 less soluble in water? The output molecule should be similar to the input molecule.
C(C[C@@H](Sc1ccccn1)c1ccccc1)=C1CC[NH2+]C1
C[NH2+]CC[C@@H](Sc1ccccn1)c1ccccc1
C(C[C@@H](Sc1ccccn1)c1ccccc1)=C1CC[NH2+]C1
102
{ "fragment_index": 0, "new_substring": "C1=2CC[NH2+]C1", "old_substring": "C[NH2+]2" }
Can you make molecule C[NH2+]CC[C@@H](Sc1ccccn1)c1ccccc1 less soluble in water? The output molecule should be similar to the input molecule.
CC[C@H](c1ccccc1)C([NH3+])(CC)CC.Sc1ccccn1
C[NH2+]CC[C@@H](Sc1ccccn1)c1ccccc1
CC[C@H](c1ccccc1)C([NH3+])(CC)CC.Sc1ccccn1
102
{ "fragment_index": 0, "new_substring": "CCC3([NH3+])CC", "old_substring": "C[NH2+]2" }
Can you make molecule C[NH2+]CC[C@@H](Sc1ccccn1)c1ccccc1 less soluble in water? The output molecule should be similar to the input molecule.
C(C[C@@H](Sc1ccccn1)c1ccccc1)=C1CC[NH2+]CC1
C[NH2+]CC[C@@H](Sc1ccccn1)c1ccccc1
C(C[C@@H](Sc1ccccn1)c1ccccc1)=C1CC[NH2+]CC1
102
{ "fragment_index": 0, "new_substring": "C1=2CC[NH2+]CC1", "old_substring": "C[NH2+]2" }
Can you make molecule C[NH2+]CC[C@@H](Sc1ccccn1)c1ccccc1 less soluble in water? The output molecule should be similar to the input molecule.
CC[C@@H](CC(C)(C)[NH3+])c1ccccc1.Sc1ccccn1
C[NH2+]CC[C@@H](Sc1ccccn1)c1ccccc1
CC[C@@H](CC(C)(C)[NH3+])c1ccccc1.Sc1ccccn1
102
{ "fragment_index": 0, "new_substring": "CC(C)([NH3+])C3", "old_substring": "C[NH2+]2" }
Can you make molecule C[NH2+]CC[C@@H](Sc1ccccn1)c1ccccc1 less soluble in water? The output molecule should be similar to the input molecule.
CCCC(C[NH3+])(CCC)[C@H](CC)c1ccccc1.Sc1ccccn1
C[NH2+]CC[C@@H](Sc1ccccn1)c1ccccc1
CCCC(C[NH3+])(CCC)[C@H](CC)c1ccccc1.Sc1ccccn1
102
{ "fragment_index": 0, "new_substring": "CCCC3(C[NH3+])CCC", "old_substring": "C[NH2+]2" }
Can you make molecule NC(=O)N1CCCN(C(=O)Nc2cc(Cl)ccc2Cl)CC1 less soluble in water? The output molecule should be similar to the input molecule.
CC(C)(CC(=O)N1CCCN(C(N)=O)CC1)Nc1cc(Cl)ccc1Cl
NC(=O)N1CCCN(C(=O)Nc2cc(Cl)ccc2Cl)CC1
CC(C)(CC(=O)N1CCCN(C(N)=O)CC1)Nc1cc(Cl)ccc1Cl
102
{ "fragment_index": 0, "new_substring": "C&(=O)CC&(C)C", "old_substring": "C45=O" }
Can you make molecule NC(=O)N1CCCN(C(=O)Nc2cc(Cl)ccc2Cl)CC1 less soluble in water? The output molecule should be similar to the input molecule.
CC(C)(CCC(=O)N1CCCN(C(N)=O)CC1)Nc1cc(Cl)ccc1Cl
NC(=O)N1CCCN(C(=O)Nc2cc(Cl)ccc2Cl)CC1
CC(C)(CCC(=O)N1CCCN(C(N)=O)CC1)Nc1cc(Cl)ccc1Cl
102
{ "fragment_index": 0, "new_substring": "C&(=O)CCC&(C)C", "old_substring": "C45=O" }
Can you make molecule NC(=O)N1CCCN(C(=O)Nc2cc(Cl)ccc2Cl)CC1 less soluble in water? The output molecule should be similar to the input molecule.
NC(=O)N1CCCN(C(=O)C[C@@H](Br)Nc2cc(Cl)ccc2Cl)CC1
NC(=O)N1CCCN(C(=O)Nc2cc(Cl)ccc2Cl)CC1
NC(=O)N1CCCN(C(=O)C[C@@H](Br)Nc2cc(Cl)ccc2Cl)CC1
102
{ "fragment_index": 0, "new_substring": "C&(=O)C[C@H]&Br", "old_substring": "C45=O" }
Can you make molecule NC(=O)N1CCCN(C(=O)Nc2cc(Cl)ccc2Cl)CC1 less soluble in water? The output molecule should be similar to the input molecule.
Cc1cc(N2CCCN(C(N)=O)CC2)cc(=O)n1Nc1cc(Cl)ccc1Cl
NC(=O)N1CCCN(C(=O)Nc2cc(Cl)ccc2Cl)CC1
Cc1cc(N2CCCN(C(N)=O)CC2)cc(=O)n1Nc1cc(Cl)ccc1Cl
102
{ "fragment_index": 0, "new_substring": "Cc1cc&cc(=O)n1&", "old_substring": "C45=O" }
Can you make molecule NC(=O)N1CCCN(C(=O)Nc2cc(Cl)ccc2Cl)CC1 less soluble in water? The output molecule should be similar to the input molecule.
Cc1c(N2CCCN(C(N)=O)CC2)c(=O)ccn1Nc1cc(Cl)ccc1Cl
NC(=O)N1CCCN(C(=O)Nc2cc(Cl)ccc2Cl)CC1
Cc1c(N2CCCN(C(N)=O)CC2)c(=O)ccn1Nc1cc(Cl)ccc1Cl
102
{ "fragment_index": 0, "new_substring": "Cc1c&c(=O)ccn1&", "old_substring": "C45=O" }
Can you make molecule CC[C@](C)(NC(=O)[C@](C)(N)c1ccccc1)C(=O)[O-] less soluble in water? The output molecule should be similar to the input molecule.
CC[C@](C)(NC(=O)[C@](C)(N)c1ccccc1Cl)C(=O)[O-]
CC[C@](C)(NC(=O)[C@](C)(N)c1ccccc1)C(=O)[O-]
CC[C@](C)(NC(=O)[C@](C)(N)c1ccccc1Cl)C(=O)[O-]
102
{ "fragment_index": 0, "new_substring": "c1&ccccc1Cl", "old_substring": "c14ccccc1" }
Can you make molecule CC[C@](C)(NC(=O)[C@](C)(N)c1ccccc1)C(=O)[O-] less soluble in water? The output molecule should be similar to the input molecule.
CC[C@](C)(NC(=O)[C@](C)(N)c1ccc(I)cc1)C(=O)[O-]
CC[C@](C)(NC(=O)[C@](C)(N)c1ccccc1)C(=O)[O-]
CC[C@](C)(NC(=O)[C@](C)(N)c1ccc(I)cc1)C(=O)[O-]
102
{ "fragment_index": 0, "new_substring": "c1&ccc(I)cc1", "old_substring": "c14ccccc1" }
Can you make molecule CC[C@](C)(NC(=O)[C@](C)(N)c1ccccc1)C(=O)[O-] less soluble in water? The output molecule should be similar to the input molecule.
CC[C@](C)(NC(=O)[C@](C)(N)c1ccc(C)c(I)c1)C(=O)[O-]
CC[C@](C)(NC(=O)[C@](C)(N)c1ccccc1)C(=O)[O-]
CC[C@](C)(NC(=O)[C@](C)(N)c1ccc(C)c(I)c1)C(=O)[O-]
102
{ "fragment_index": 0, "new_substring": "Cc1ccc&cc1I", "old_substring": "c14ccccc1" }
Can you make molecule CC[C@](C)(NC(=O)[C@](C)(N)c1ccccc1)C(=O)[O-] less soluble in water? The output molecule should be similar to the input molecule.
CC[C@](C)(NC(=O)[C@](C)(N)c1cccc(Br)c1)C(=O)[O-]
CC[C@](C)(NC(=O)[C@](C)(N)c1ccccc1)C(=O)[O-]
CC[C@](C)(NC(=O)[C@](C)(N)c1cccc(Br)c1)C(=O)[O-]
102
{ "fragment_index": 0, "new_substring": "Brc1cccc&c1", "old_substring": "c14ccccc1" }
Can you make molecule CC[C@](C)(NC(=O)[C@](C)(N)c1ccccc1)C(=O)[O-] less soluble in water? The output molecule should be similar to the input molecule.
CC[C@](C)(NC(=O)[C@](C)(N)c1cccc(C)c1C)C(=O)[O-]
CC[C@](C)(NC(=O)[C@](C)(N)c1ccccc1)C(=O)[O-]
CC[C@](C)(NC(=O)[C@](C)(N)c1cccc(C)c1C)C(=O)[O-]
102
{ "fragment_index": 0, "new_substring": "c1&cccc(C)c1C", "old_substring": "c14ccccc1" }
Can you make molecule Cc1ccc2c(c1)sc[n+]2Cc1ccc(CBr)cc1 less soluble in water? The output molecule should be similar to the input molecule.
Cc1ccc2c(c1)sc[n+]2Cc1ccc(CBr)cc1I
Cc1ccc2c(c1)sc[n+]2Cc1ccc(CBr)cc1
Cc1ccc2c(c1)sc[n+]2Cc1ccc(CBr)cc1I
102
{ "fragment_index": 0, "new_substring": "c1&ccc&cc1I", "old_substring": "c13ccc4cc1" }
Can you make molecule Cc1ccc2c(c1)sc[n+]2Cc1ccc(CBr)cc1 less soluble in water? The output molecule should be similar to the input molecule.
Cc1ccc2c(c1)sc[n+]2Cc1cc(CBr)ccc1Br
Cc1ccc2c(c1)sc[n+]2Cc1ccc(CBr)cc1
Cc1ccc2c(c1)sc[n+]2Cc1cc(CBr)ccc1Br
102
{ "fragment_index": 0, "new_substring": "c1&cc&ccc1Br", "old_substring": "c13ccc4cc1" }
Can you make molecule Cc1ccc2c(c1)sc[n+]2Cc1ccc(CBr)cc1 less soluble in water? The output molecule should be similar to the input molecule.
Cc1ccc2c(c1)sc[n+]2Cc1ccc(CBr)cc1Cl
Cc1ccc2c(c1)sc[n+]2Cc1ccc(CBr)cc1
Cc1ccc2c(c1)sc[n+]2Cc1ccc(CBr)cc1Cl
102
{ "fragment_index": 0, "new_substring": "c1&ccc&cc1Cl", "old_substring": "c13ccc4cc1" }
Can you make molecule Cc1ccc2c(c1)sc[n+]2Cc1ccc(CBr)cc1 less soluble in water? The output molecule should be similar to the input molecule.
Cc1ccc2c(c1)sc[n+]2Cc1cccc(CBr)c1Br
Cc1ccc2c(c1)sc[n+]2Cc1ccc(CBr)cc1
Cc1ccc2c(c1)sc[n+]2Cc1cccc(CBr)c1Br
102
{ "fragment_index": 0, "new_substring": "c1&cccc&c1Br", "old_substring": "c13ccc4cc1" }
Can you make molecule Cc1ccc2c(c1)sc[n+]2Cc1ccc(CBr)cc1 less soluble in water? The output molecule should be similar to the input molecule.
Cc1ccc2c(c1)sc[n+]2Cc1cccc(CBr)c1Cl
Cc1ccc2c(c1)sc[n+]2Cc1ccc(CBr)cc1
Cc1ccc2c(c1)sc[n+]2Cc1cccc(CBr)c1Cl
102
{ "fragment_index": 0, "new_substring": "c1&cccc&c1Cl", "old_substring": "c13ccc4cc1" }
Can you make molecule Cc1cc(C)c2c(c1)s/c(=N/C(=O)c1cccc(N3C(=O)CCC3=O)c1)n2C less soluble in water? The output molecule should be similar to the input molecule.
Cc1cc(C)c2c(c1)s/c(=N/C(=O)c1ccc(N3C(=O)CCC3=O)cc1I)n2C
Cc1cc(C)c2c(c1)s/c(=N/C(=O)c1cccc(N3C(=O)CCC3=O)c1)n2C
Cc1cc(C)c2c(c1)s/c(=N/C(=O)c1ccc(N3C(=O)CCC3=O)cc1I)n2C
102
{ "fragment_index": 0, "new_substring": "c1&ccc&cc1I", "old_substring": "c14cccc5c1" }
Can you make molecule Cc1cc(C)c2c(c1)s/c(=N/C(=O)c1cccc(N3C(=O)CCC3=O)c1)n2C less soluble in water? The output molecule should be similar to the input molecule.
Cc1cc(C)c2c(c1)s/c(=N/C(=O)c1cc(N3C(=O)CCC3=O)ccc1Br)n2C
Cc1cc(C)c2c(c1)s/c(=N/C(=O)c1cccc(N3C(=O)CCC3=O)c1)n2C
Cc1cc(C)c2c(c1)s/c(=N/C(=O)c1cc(N3C(=O)CCC3=O)ccc1Br)n2C
102
{ "fragment_index": 0, "new_substring": "c1&cc&ccc1Br", "old_substring": "c14cccc5c1" }
Can you make molecule Cc1cc(C)c2c(c1)s/c(=N/C(=O)c1cccc(N3C(=O)CCC3=O)c1)n2C less soluble in water? The output molecule should be similar to the input molecule.
Cc1cc(C)c2c(c1)s/c(=N/C(=O)c1ccc(N3C(=O)CCC3=O)cc1Cl)n2C
Cc1cc(C)c2c(c1)s/c(=N/C(=O)c1cccc(N3C(=O)CCC3=O)c1)n2C
Cc1cc(C)c2c(c1)s/c(=N/C(=O)c1ccc(N3C(=O)CCC3=O)cc1Cl)n2C
102
{ "fragment_index": 0, "new_substring": "c1&ccc&cc1Cl", "old_substring": "c14cccc5c1" }
Can you make molecule Cc1cc(C)c2c(c1)s/c(=N/C(=O)c1cccc(N3C(=O)CCC3=O)c1)n2C less soluble in water? The output molecule should be similar to the input molecule.
Cc1cc(C)c2c(c1)s/c(=N/C(=O)c1cccc(N3C(=O)CCC3=O)c1Br)n2C
Cc1cc(C)c2c(c1)s/c(=N/C(=O)c1cccc(N3C(=O)CCC3=O)c1)n2C
Cc1cc(C)c2c(c1)s/c(=N/C(=O)c1cccc(N3C(=O)CCC3=O)c1Br)n2C
102
{ "fragment_index": 0, "new_substring": "c1&cccc&c1Br", "old_substring": "c14cccc5c1" }
Can you make molecule Cc1cc(C)c2c(c1)s/c(=N/C(=O)c1cccc(N3C(=O)CCC3=O)c1)n2C less soluble in water? The output molecule should be similar to the input molecule.
Cc1cc(C)c2c(c1)s/c(=N/C(=O)c1cccc(N3C(=O)CCC3=O)c1Cl)n2C
Cc1cc(C)c2c(c1)s/c(=N/C(=O)c1cccc(N3C(=O)CCC3=O)c1)n2C
Cc1cc(C)c2c(c1)s/c(=N/C(=O)c1cccc(N3C(=O)CCC3=O)c1Cl)n2C
102
{ "fragment_index": 0, "new_substring": "c1&cccc&c1Cl", "old_substring": "c14cccc5c1" }
Can you make molecule CCCNS(=O)(=O)c1ccc(NC(=O)[C@@H]2C[C@@H]2C)cc1 less soluble in water? The output molecule should be similar to the input molecule.
CCCNS(=O)(=O)c1ccc(NSC(=O)C[C@@H]2C[C@@H]2C)cc1
CCCNS(=O)(=O)c1ccc(NC(=O)[C@@H]2C[C@@H]2C)cc1
CCCNS(=O)(=O)c1ccc(NSC(=O)C[C@@H]2C[C@@H]2C)cc1
102
{ "fragment_index": 0, "new_substring": "S&C(=O)C&", "old_substring": "C37=O" }
Can you make molecule CCCNS(=O)(=O)c1ccc(NC(=O)[C@@H]2C[C@@H]2C)cc1 less soluble in water? The output molecule should be similar to the input molecule.
CCCNS(=O)(=O)c1ccc(NCC(=C=O)C[C@@H]2C[C@@H]2C)cc1
CCCNS(=O)(=O)c1ccc(NC(=O)[C@@H]2C[C@@H]2C)cc1
CCCNS(=O)(=O)c1ccc(NCC(=C=O)C[C@@H]2C[C@@H]2C)cc1
102
{ "fragment_index": 0, "new_substring": "C&C(=C=O)C&", "old_substring": "C37=O" }
Can you make molecule CCCNS(=O)(=O)c1ccc(NC(=O)[C@@H]2C[C@@H]2C)cc1 less soluble in water? The output molecule should be similar to the input molecule.
CCCNS(=O)(=O)c1ccc(NC(=O)CCCC(=O)[C@@H]2C[C@@H]2C)cc1
CCCNS(=O)(=O)c1ccc(NC(=O)[C@@H]2C[C@@H]2C)cc1
CCCNS(=O)(=O)c1ccc(NC(=O)CCCC(=O)[C@@H]2C[C@@H]2C)cc1
102
{ "fragment_index": 0, "new_substring": "C&(=O)CCCC&=O", "old_substring": "C37=O" }
Can you make molecule CCCNS(=O)(=O)c1ccc(NC(=O)[C@@H]2C[C@@H]2C)cc1 less soluble in water? The output molecule should be similar to the input molecule.
CCCNS(=O)(=O)c1ccc(NC(=O)CC(C)(C)[C@@H]2C[C@@H]2C)cc1
CCCNS(=O)(=O)c1ccc(NC(=O)[C@@H]2C[C@@H]2C)cc1
CCCNS(=O)(=O)c1ccc(NC(=O)CC(C)(C)[C@@H]2C[C@@H]2C)cc1
102
{ "fragment_index": 0, "new_substring": "C&(=O)CC&(C)C", "old_substring": "C37=O" }
Can you make molecule CCCNS(=O)(=O)c1ccc(NC(=O)[C@@H]2C[C@@H]2C)cc1 less soluble in water? The output molecule should be similar to the input molecule.
CCCNS(=O)(=O)c1ccc(NC[S@+]([O-])CCC[C@@H]2C[C@@H]2C)cc1
CCCNS(=O)(=O)c1ccc(NC(=O)[C@@H]2C[C@@H]2C)cc1
CCCNS(=O)(=O)c1ccc(NC[S@+]([O-])CCC[C@@H]2C[C@@H]2C)cc1
102
{ "fragment_index": 0, "new_substring": "C&[S@](=O)CCC&", "old_substring": "C37=O" }
Can you make molecule N#Cc1cnn(-c2ccc(N)cc2)c1Cl less soluble in water? The output molecule should be similar to the input molecule.
N#Cc1cnn(-c2ccc(N)cc2Cl)c1Cl
N#Cc1cnn(-c2ccc(N)cc2)c1Cl
N#Cc1cnn(-c2ccc(N)cc2Cl)c1Cl
102
{ "fragment_index": 0, "new_substring": "c1&ccc(N)cc1Cl", "old_substring": "c13ccc(N)cc1" }
Can you make molecule N#Cc1cnn(-c2ccc(N)cc2)c1Cl less soluble in water? The output molecule should be similar to the input molecule.
N#Cc1cnn(-c2ccc(I)cc2)c1Cl
N#Cc1cnn(-c2ccc(N)cc2)c1Cl
N#Cc1cnn(-c2ccc(I)cc2)c1Cl
102
{ "fragment_index": 0, "new_substring": "c1&ccc(I)cc1", "old_substring": "c13ccc(N)cc1" }
Can you make molecule N#Cc1cnn(-c2ccc(N)cc2)c1Cl less soluble in water? The output molecule should be similar to the input molecule.
Cc1cc(C#N)ccc1-n1ncc(C#N)c1Cl
N#Cc1cnn(-c2ccc(N)cc2)c1Cl
Cc1cc(C#N)ccc1-n1ncc(C#N)c1Cl
102
{ "fragment_index": 0, "new_substring": "c1&ccc(C#N)cc1C", "old_substring": "c13ccc(N)cc1" }
Can you make molecule N#Cc1cnn(-c2ccc(N)cc2)c1Cl less soluble in water? The output molecule should be similar to the input molecule.
N#Cc1ccc(-n2ncc(C#N)c2Cl)c(Cl)c1
N#Cc1cnn(-c2ccc(N)cc2)c1Cl
N#Cc1ccc(-n2ncc(C#N)c2Cl)c(Cl)c1
102
{ "fragment_index": 0, "new_substring": "c1&ccc(C#N)cc1Cl", "old_substring": "c13ccc(N)cc1" }
Can you make molecule N#Cc1cnn(-c2ccc(N)cc2)c1Cl less soluble in water? The output molecule should be similar to the input molecule.
N#Cc1cnn(-c2ccc(N)c(Br)c2)c1Cl
N#Cc1cnn(-c2ccc(N)cc2)c1Cl
N#Cc1cnn(-c2ccc(N)c(Br)c2)c1Cl
102
{ "fragment_index": 0, "new_substring": "c1&ccc(N)c(Br)c1", "old_substring": "c13ccc(N)cc1" }
Can you make molecule CNC(=O)CCN1CCN(S(=O)(=O)c2cc(C)ccc2C)CC1 less soluble in water? The output molecule should be similar to the input molecule.
CNC(=O)CC(C)(C)N1CCN(S(=O)(=O)c2cc(C)ccc2C)CC1
CNC(=O)CCN1CCN(S(=O)(=O)c2cc(C)ccc2C)CC1
CNC(=O)CC(C)(C)N1CCN(S(=O)(=O)c2cc(C)ccc2C)CC1
102
{ "fragment_index": 0, "new_substring": "C&(=O)CC&(C)C", "old_substring": "C3(=O)CC4" }
Can you make molecule CNC(=O)CCN1CCN(S(=O)(=O)c2cc(C)ccc2C)CC1 less soluble in water? The output molecule should be similar to the input molecule.
CNC(=O)CCC(C)(C)N1CCN(S(=O)(=O)c2cc(C)ccc2C)CC1
CNC(=O)CCN1CCN(S(=O)(=O)c2cc(C)ccc2C)CC1
CNC(=O)CCC(C)(C)N1CCN(S(=O)(=O)c2cc(C)ccc2C)CC1
102
{ "fragment_index": 0, "new_substring": "C&(=O)CCC&(C)C", "old_substring": "C3(=O)CC4" }
Can you make molecule CNC(=O)CCN1CCN(S(=O)(=O)c2cc(C)ccc2C)CC1 less soluble in water? The output molecule should be similar to the input molecule.
CNC(=O)C[C@@H](Br)N1CCN(S(=O)(=O)c2cc(C)ccc2C)CC1
CNC(=O)CCN1CCN(S(=O)(=O)c2cc(C)ccc2C)CC1
CNC(=O)C[C@@H](Br)N1CCN(S(=O)(=O)c2cc(C)ccc2C)CC1
102
{ "fragment_index": 0, "new_substring": "C&(=O)C[C@H]&Br", "old_substring": "C3(=O)CC4" }
Can you make molecule CNC(=O)CCN1CCN(S(=O)(=O)c2cc(C)ccc2C)CC1 less soluble in water? The output molecule should be similar to the input molecule.
CNSC(=O)[C@@H](C)N1CCN(S(=O)(=O)c2cc(C)ccc2C)CC1
CNC(=O)CCN1CCN(S(=O)(=O)c2cc(C)ccc2C)CC1
CNSC(=O)[C@@H](C)N1CCN(S(=O)(=O)c2cc(C)ccc2C)CC1
102
{ "fragment_index": 0, "new_substring": "S&C(=O)[C@H]&C", "old_substring": "C3(=O)CC4" }
Can you make molecule CNC(=O)CCN1CCN(S(=O)(=O)c2cc(C)ccc2C)CC1 less soluble in water? The output molecule should be similar to the input molecule.
CNC(=O)[C@H](C)CCN1CCN(S(=O)(=O)c2cc(C)ccc2C)CC1
CNC(=O)CCN1CCN(S(=O)(=O)c2cc(C)ccc2C)CC1
CNC(=O)[C@H](C)CCN1CCN(S(=O)(=O)c2cc(C)ccc2C)CC1
102
{ "fragment_index": 0, "new_substring": "C&(=O)[C@H](C)CC&", "old_substring": "C3(=O)CC4" }
Can you make molecule O=C(CSc1cccc(C(F)(F)F)c1)N1CCN(S(=O)(=O)c2cccs2)CC1 less soluble in water? The output molecule should be similar to the input molecule.
O=C(/C=C/SSc1cccc(C(F)(F)F)c1)N1CCN(S(=O)(=O)c2cccs2)CC1
O=C(CSc1cccc(C(F)(F)F)c1)N1CCN(S(=O)(=O)c2cccs2)CC1
O=C(/C=C/SSc1cccc(C(F)(F)F)c1)N1CCN(S(=O)(=O)c2cccs2)CC1
102
{ "fragment_index": 0, "new_substring": "O=C&/C=C/S&", "old_substring": "O=C3C4" }
Can you make molecule O=C(CSc1cccc(C(F)(F)F)c1)N1CCN(S(=O)(=O)c2cccs2)CC1 less soluble in water? The output molecule should be similar to the input molecule.
O=S(=O)(c1cccs1)N1CCN(ON=C2CCN(Sc3cccc(C(F)(F)F)c3)CC2)CC1
O=C(CSc1cccc(C(F)(F)F)c1)N1CCN(S(=O)(=O)c2cccs2)CC1
O=S(=O)(c1cccs1)N1CCN(ON=C2CCN(Sc3cccc(C(F)(F)F)c3)CC2)CC1
102
{ "fragment_index": 0, "new_substring": "O&N=C1CCN&CC1", "old_substring": "O=C3C4" }
Can you make molecule O=C(CSc1cccc(C(F)(F)F)c1)N1CCN(S(=O)(=O)c2cccs2)CC1 less soluble in water? The output molecule should be similar to the input molecule.
O=C(NN=C1CCN(Sc2cccc(C(F)(F)F)c2)CC1)N1CCN(S(=O)(=O)c2cccs2)CC1
O=C(CSc1cccc(C(F)(F)F)c1)N1CCN(S(=O)(=O)c2cccs2)CC1
O=C(NN=C1CCN(Sc2cccc(C(F)(F)F)c2)CC1)N1CCN(S(=O)(=O)c2cccs2)CC1
102
{ "fragment_index": 0, "new_substring": "O=C&NN=C1CCN&CC1", "old_substring": "O=C3C4" }
Can you make molecule O=C(CSc1cccc(C(F)(F)F)c1)N1CCN(S(=O)(=O)c2cccs2)CC1 less soluble in water? The output molecule should be similar to the input molecule.
O=C(NN=C1CCC(Sc2cccc(C(F)(F)F)c2)CC1)N1CCN(S(=O)(=O)c2cccs2)CC1
O=C(CSc1cccc(C(F)(F)F)c1)N1CCN(S(=O)(=O)c2cccs2)CC1
O=C(NN=C1CCC(Sc2cccc(C(F)(F)F)c2)CC1)N1CCN(S(=O)(=O)c2cccs2)CC1
102
{ "fragment_index": 0, "new_substring": "O=C&NN=C1CCC&CC1", "old_substring": "O=C3C4" }
Can you make molecule O=C(CSc1cccc(C(F)(F)F)c1)N1CCN(S(=O)(=O)c2cccs2)CC1 less soluble in water? The output molecule should be similar to the input molecule.
C/C(=N\ON1CCN(S(=O)(=O)c2cccs2)CC1)C(=O)SSc1cccc(C(F)(F)F)c1
O=C(CSc1cccc(C(F)(F)F)c1)N1CCN(S(=O)(=O)c2cccs2)CC1
C/C(=N\ON1CCN(S(=O)(=O)c2cccs2)CC1)C(=O)SSc1cccc(C(F)(F)F)c1
102
{ "fragment_index": 0, "new_substring": "O&/N=C(\\C)C(=O)S&", "old_substring": "O=C3C4" }
Can you make molecule CC(C)N1CC[C@H]([NH2+][C@H](C)CCc2ccc3c(c2)OCO3)C1=O less soluble in water? The output molecule should be similar to the input molecule.
CC(C)CCN1CC[C@H]([NH2+][C@H](C)CCc2ccc3c(c2)OCO3)C1=O
CC(C)N1CC[C@H]([NH2+][C@H](C)CCc2ccc3c(c2)OCO3)C1=O
CC(C)CCN1CC[C@H]([NH2+][C@H](C)CCc2ccc3c(c2)OCO3)C1=O
102
{ "fragment_index": 0, "new_substring": "CC(C)CC&", "old_substring": "CC6C" }
Can you make molecule CC(C)N1CC[C@H]([NH2+][C@H](C)CCc2ccc3c(c2)OCO3)C1=O less soluble in water? The output molecule should be similar to the input molecule.
C[C@H](CCc1ccc2c(c1)OCO2)[NH2+][C@H]1CCN(CCCCBr)C1=O
CC(C)N1CC[C@H]([NH2+][C@H](C)CCc2ccc3c(c2)OCO3)C1=O
C[C@H](CCc1ccc2c(c1)OCO2)[NH2+][C@H]1CCN(CCCCBr)C1=O
102
{ "fragment_index": 0, "new_substring": "C&CCCBr", "old_substring": "CC6C" }
Can you make molecule CC(C)N1CC[C@H]([NH2+][C@H](C)CCc2ccc3c(c2)OCO3)C1=O less soluble in water? The output molecule should be similar to the input molecule.
C=CCCCN1CC[C@H]([NH2+][C@H](C)CCc2ccc3c(c2)OCO3)C1=O
CC(C)N1CC[C@H]([NH2+][C@H](C)CCc2ccc3c(c2)OCO3)C1=O
C=CCCCN1CC[C@H]([NH2+][C@H](C)CCc2ccc3c(c2)OCO3)C1=O
102
{ "fragment_index": 0, "new_substring": "C=CCCC&", "old_substring": "CC6C" }
Can you make molecule CC(C)N1CC[C@H]([NH2+][C@H](C)CCc2ccc3c(c2)OCO3)C1=O less soluble in water? The output molecule should be similar to the input molecule.
C[C@H](CCc1ccc2c(c1)OCO2)[NH2+][C@H]1CCN(CCCCCl)C1=O
CC(C)N1CC[C@H]([NH2+][C@H](C)CCc2ccc3c(c2)OCO3)C1=O
C[C@H](CCc1ccc2c(c1)OCO2)[NH2+][C@H]1CCN(CCCCCl)C1=O
102
{ "fragment_index": 0, "new_substring": "C&CCCCl", "old_substring": "CC6C" }
Can you make molecule CC(C)N1CC[C@H]([NH2+][C@H](C)CCc2ccc3c(c2)OCO3)C1=O less soluble in water? The output molecule should be similar to the input molecule.
C=CCCCCN1CC[C@H]([NH2+][C@H](C)CCc2ccc3c(c2)OCO3)C1=O
CC(C)N1CC[C@H]([NH2+][C@H](C)CCc2ccc3c(c2)OCO3)C1=O
C=CCCCCN1CC[C@H]([NH2+][C@H](C)CCc2ccc3c(c2)OCO3)C1=O
102
{ "fragment_index": 0, "new_substring": "C=CCCCC&", "old_substring": "CC6C" }