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 C[C@@H](c1cccc(-c2ccc(C3(O)CC[NH2+]CC3)cc2)c1)[NH+]1CCCC1 less soluble in water? The output molecule should be similar to the input molecule.
C[C@@H](c1cccc(-c2ccc(C3(O)CC[NH2+]CC3)cc2)c1)[NH+]1CCCCCC1
C[C@@H](c1cccc(-c2ccc(C3(O)CC[NH2+]CC3)cc2)c1)[NH+]1CCCC1
C[C@@H](c1cccc(-c2ccc(C3(O)CC[NH2+]CC3)cc2)c1)[NH+]1CCCCCC1
102
{ "fragment_index": 0, "new_substring": "[NH+]1&CCCCCC1", "old_substring": "[NH+]14CCCC1" }
Can you make molecule C[C@@H](c1cccc(-c2ccc(C3(O)CC[NH2+]CC3)cc2)c1)[NH+]1CCCC1 less soluble in water? The output molecule should be similar to the input molecule.
C[C@@H](c1cccc(-c2ccc(C3(O)CC[NH2+]CC3)cc2)c1)[NH+]1CCCCCCC1
C[C@@H](c1cccc(-c2ccc(C3(O)CC[NH2+]CC3)cc2)c1)[NH+]1CCCC1
C[C@@H](c1cccc(-c2ccc(C3(O)CC[NH2+]CC3)cc2)c1)[NH+]1CCCCCCC1
102
{ "fragment_index": 0, "new_substring": "[NH+]1&CCCCCCC1", "old_substring": "[NH+]14CCCC1" }
Can you make molecule C[C@@H](c1cccc(-c2ccc(C3(O)CC[NH2+]CC3)cc2)c1)[NH+]1CCCC1 less soluble in water? The output molecule should be similar to the input molecule.
C[C@@H](c1cccc(-c2ccc(C3(O)CC[NH2+]CC3)cc2)c1)[NH+]1CCCC1(C)C
C[C@@H](c1cccc(-c2ccc(C3(O)CC[NH2+]CC3)cc2)c1)[NH+]1CCCC1
C[C@@H](c1cccc(-c2ccc(C3(O)CC[NH2+]CC3)cc2)c1)[NH+]1CCCC1(C)C
102
{ "fragment_index": 0, "new_substring": "[NH+]1&CCCC1(C)C", "old_substring": "[NH+]14CCCC1" }
Can you make molecule C[C@@H](c1cccc(-c2ccc(C3(O)CC[NH2+]CC3)cc2)c1)[NH+]1CCCC1 less soluble in water? The output molecule should be similar to the input molecule.
C[C@@H]1CCCC[NH+]1[C@@H](C)c1cccc(-c2ccc(C3(O)CC[NH2+]CC3)cc2)c1
C[C@@H](c1cccc(-c2ccc(C3(O)CC[NH2+]CC3)cc2)c1)[NH+]1CCCC1
C[C@@H]1CCCC[NH+]1[C@@H](C)c1cccc(-c2ccc(C3(O)CC[NH2+]CC3)cc2)c1
102
{ "fragment_index": 0, "new_substring": "[NH+]1&CCCC[C@H]1C", "old_substring": "[NH+]14CCCC1" }
Can you make molecule C[C@@H](c1cccc(-c2ccc(C3(O)CC[NH2+]CC3)cc2)c1)[NH+]1CCCC1 less soluble in water? The output molecule should be similar to the input molecule.
C[C@@H](c1cccc(-c2ccc(C3(O)CC[NH2+]CC3)cc2)c1)[NH+]1CCC(C)(C)C1
C[C@@H](c1cccc(-c2ccc(C3(O)CC[NH2+]CC3)cc2)c1)[NH+]1CCCC1
C[C@@H](c1cccc(-c2ccc(C3(O)CC[NH2+]CC3)cc2)c1)[NH+]1CCC(C)(C)C1
102
{ "fragment_index": 0, "new_substring": "[NH+]1&CCC(C)(C)C1", "old_substring": "[NH+]14CCCC1" }
Can you make molecule O=C(Nc1ccnn1Cc1ccc(Cl)cc1)[C@@H]1COc2ccccc2O1 less soluble in water? The output molecule should be similar to the input molecule.
O=C(/C=C/S[C@@H]1COc2ccccc2O1)Nc1ccnn1Cc1ccc(Cl)cc1
O=C(Nc1ccnn1Cc1ccc(Cl)cc1)[C@@H]1COc2ccccc2O1
O=C(/C=C/S[C@@H]1COc2ccccc2O1)Nc1ccnn1Cc1ccc(Cl)cc1
102
{ "fragment_index": 0, "new_substring": "O=C&/C=C/S&", "old_substring": "O=C35" }
Can you make molecule O=C(Nc1ccnn1Cc1ccc(Cl)cc1)[C@@H]1COc2ccccc2O1 less soluble in water? The output molecule should be similar to the input molecule.
O=Cc1sc(Nc2ccnn2Cc2ccc(Cl)cc2)nc1[C@@H]1COc2ccccc2O1
O=C(Nc1ccnn1Cc1ccc(Cl)cc1)[C@@H]1COc2ccccc2O1
O=Cc1sc(Nc2ccnn2Cc2ccc(Cl)cc2)nc1[C@@H]1COc2ccccc2O1
102
{ "fragment_index": 0, "new_substring": "O=Cc1sc&nc1&", "old_substring": "O=C35" }
Can you make molecule O=C(Nc1ccnn1Cc1ccc(Cl)cc1)[C@@H]1COc2ccccc2O1 less soluble in water? The output molecule should be similar to the input molecule.
O=Cc1nc(Nc2ccnn2Cc2ccc(Cl)cc2)sc1[C@@H]1COc2ccccc2O1
O=C(Nc1ccnn1Cc1ccc(Cl)cc1)[C@@H]1COc2ccccc2O1
O=Cc1nc(Nc2ccnn2Cc2ccc(Cl)cc2)sc1[C@@H]1COc2ccccc2O1
102
{ "fragment_index": 0, "new_substring": "O=Cc1nc&sc1&", "old_substring": "O=C35" }
Can you make molecule O=C(Nc1ccnn1Cc1ccc(Cl)cc1)[C@@H]1COc2ccccc2O1 less soluble in water? The output molecule should be similar to the input molecule.
O=C(N/N=C/C[C@@H]1COc2ccccc2O1)Nc1ccnn1Cc1ccc(Cl)cc1
O=C(Nc1ccnn1Cc1ccc(Cl)cc1)[C@@H]1COc2ccccc2O1
O=C(N/N=C/C[C@@H]1COc2ccccc2O1)Nc1ccnn1Cc1ccc(Cl)cc1
102
{ "fragment_index": 0, "new_substring": "O=C&N/N=C/C&", "old_substring": "O=C35" }
Can you make molecule O=C(Nc1ccnn1Cc1ccc(Cl)cc1)[C@@H]1COc2ccccc2O1 less soluble in water? The output molecule should be similar to the input molecule.
Clc1ccc(Cn2nccc2NON=C2CCN([C@@H]3COc4ccccc4O3)CC2)cc1
O=C(Nc1ccnn1Cc1ccc(Cl)cc1)[C@@H]1COc2ccccc2O1
Clc1ccc(Cn2nccc2NON=C2CCN([C@@H]3COc4ccccc4O3)CC2)cc1
102
{ "fragment_index": 0, "new_substring": "O&N=C1CCN&CC1", "old_substring": "O=C35" }
Can you make molecule CC(C)(C)OC(=O)NC[C@@H]1CCCC[C@@H]1NC(=O)CC1CCC1 less soluble in water? The output molecule should be similar to the input molecule.
CC(C)(C)OC(=O)NC[C@@H]1CCCC[C@@H]1NC(=O)CC1CCCCC1
CC(C)(C)OC(=O)NC[C@@H]1CCCC[C@@H]1NC(=O)CC1CCC1
CC(C)(C)OC(=O)NC[C@@H]1CCCC[C@@H]1NC(=O)CC1CCCCC1
102
{ "fragment_index": 0, "new_substring": "C1&CCCCC1", "old_substring": "C19CCC1" }
Can you make molecule CC(C)(C)OC(=O)NC[C@@H]1CCCC[C@@H]1NC(=O)CC1CCC1 less soluble in water? The output molecule should be similar to the input molecule.
CC(C)(C)OC(=O)NC[C@@H]1CCCC[C@@H]1NC(=O)C=C1CCCCC1
CC(C)(C)OC(=O)NC[C@@H]1CCCC[C@@H]1NC(=O)CC1CCC1
CC(C)(C)OC(=O)NC[C@@H]1CCCC[C@@H]1NC(=O)C=C1CCCCC1
102
{ "fragment_index": 0, "new_substring": "C1=&CCCCC1", "old_substring": "C19CCC1" }
Can you make molecule CC(C)(C)OC(=O)NC[C@@H]1CCCC[C@@H]1NC(=O)CC1CCC1 less soluble in water? The output molecule should be similar to the input molecule.
CC(C)(C)OC(=O)NC[C@@H]1CCCC[C@@H]1NC(=O)CC1CCCCCC1
CC(C)(C)OC(=O)NC[C@@H]1CCCC[C@@H]1NC(=O)CC1CCC1
CC(C)(C)OC(=O)NC[C@@H]1CCCC[C@@H]1NC(=O)CC1CCCCCC1
102
{ "fragment_index": 0, "new_substring": "C1&CCCCCC1", "old_substring": "C19CCC1" }
Can you make molecule CC(C)(C)OC(=O)NC[C@@H]1CCCC[C@@H]1NC(=O)CC1CCC1 less soluble in water? The output molecule should be similar to the input molecule.
CC1(CC(=O)N[C@H]2CCCC[C@H]2CNC(=O)OC(C)(C)C)CCCC1
CC(C)(C)OC(=O)NC[C@@H]1CCCC[C@@H]1NC(=O)CC1CCC1
CC1(CC(=O)N[C@H]2CCCC[C@H]2CNC(=O)OC(C)(C)C)CCCC1
102
{ "fragment_index": 0, "new_substring": "C1&(C)CCCC1", "old_substring": "C19CCC1" }
Can you make molecule CC(C)(C)OC(=O)NC[C@@H]1CCCC[C@@H]1NC(=O)CC1CCC1 less soluble in water? The output molecule should be similar to the input molecule.
CC(C)(C)OC(=O)NC[C@@H]1CCCC[C@@H]1NC(=O)CC1CCCCCCC1
CC(C)(C)OC(=O)NC[C@@H]1CCCC[C@@H]1NC(=O)CC1CCC1
CC(C)(C)OC(=O)NC[C@@H]1CCCC[C@@H]1NC(=O)CC1CCCCCCC1
102
{ "fragment_index": 0, "new_substring": "C1&CCCCCCC1", "old_substring": "C19CCC1" }
Can you make molecule C[C@@H](N[C@H]1CCCSc2ccccc21)c1nc(-c2ccncc2)cs1 less soluble in water? The output molecule should be similar to the input molecule.
C[C@@H](N[C@H]1CCCSc2ccccc21)c1nc(-c2ccncc2Cl)cs1
C[C@@H](N[C@H]1CCCSc2ccccc21)c1nc(-c2ccncc2)cs1
C[C@@H](N[C@H]1CCCSc2ccccc21)c1nc(-c2ccncc2Cl)cs1
102
{ "fragment_index": 0, "new_substring": "c1&ccncc1Cl", "old_substring": "c15ccncc1" }
Can you make molecule C[C@@H](N[C@H]1CCCSc2ccccc21)c1nc(-c2ccncc2)cs1 less soluble in water? The output molecule should be similar to the input molecule.
C[C@@H](N[C@H]1CCCSc2ccccc21)c1nc(-c2ccccc2)cs1
C[C@@H](N[C@H]1CCCSc2ccccc21)c1nc(-c2ccncc2)cs1
C[C@@H](N[C@H]1CCCSc2ccccc21)c1nc(-c2ccccc2)cs1
102
{ "fragment_index": 0, "new_substring": "c1&ccccc1", "old_substring": "c15ccncc1" }
Can you make molecule C[C@@H](N[C@H]1CCCSc2ccccc21)c1nc(-c2ccncc2)cs1 less soluble in water? The output molecule should be similar to the input molecule.
C[C@@H](N[C@H]1CCCSc2ccccc21)c1nc(-c2cnccc2Cl)cs1
C[C@@H](N[C@H]1CCCSc2ccccc21)c1nc(-c2ccncc2)cs1
C[C@@H](N[C@H]1CCCSc2ccccc21)c1nc(-c2cnccc2Cl)cs1
102
{ "fragment_index": 0, "new_substring": "c1&cnccc1Cl", "old_substring": "c15ccncc1" }
Can you make molecule C[C@@H](N[C@H]1CCCSc2ccccc21)c1nc(-c2ccncc2)cs1 less soluble in water? The output molecule should be similar to the input molecule.
C[C@@H](N[C@H]1CCCSc2ccccc21)c1nc(-c2cc(Br)ncc2F)cs1
C[C@@H](N[C@H]1CCCSc2ccccc21)c1nc(-c2ccncc2)cs1
C[C@@H](N[C@H]1CCCSc2ccccc21)c1nc(-c2cc(Br)ncc2F)cs1
102
{ "fragment_index": 0, "new_substring": "c1&cc(Br)ncc1F", "old_substring": "c15ccncc1" }
Can you make molecule C[C@@H](N[C@H]1CCCSc2ccccc21)c1nc(-c2ccncc2)cs1 less soluble in water? The output molecule should be similar to the input molecule.
Cc1cc(-c2csc([C@@H](C)N[C@H]3CCCSc4ccccc43)n2)ncc1Br
C[C@@H](N[C@H]1CCCSc2ccccc21)c1nc(-c2ccncc2)cs1
Cc1cc(-c2csc([C@@H](C)N[C@H]3CCCSc4ccccc43)n2)ncc1Br
102
{ "fragment_index": 0, "new_substring": "Cc1cc&ncc1Br", "old_substring": "c15ccncc1" }
Can you make molecule CCC1CCC(C[NH2+][C@@H]2CCC[C@H]2[C@@H]2CCCC[NH2+]2)CC1 less soluble in water? The output molecule should be similar to the input molecule.
CC(I)=C1CCC(C[NH2+][C@@H]2CCC[C@H]2[C@@H]2CCCC[NH2+]2)CC1
CCC1CCC(C[NH2+][C@@H]2CCC[C@H]2[C@@H]2CCCC[NH2+]2)CC1
CC(I)=C1CCC(C[NH2+][C@@H]2CCC[C@H]2[C@@H]2CCCC[NH2+]2)CC1
102
{ "fragment_index": 0, "new_substring": "CC=&I", "old_substring": "CC5" }
Can you make molecule CCC1CCC(C[NH2+][C@@H]2CCC[C@H]2[C@@H]2CCCC[NH2+]2)CC1 less soluble in water? The output molecule should be similar to the input molecule.
C=CCCC1CCC(C[NH2+][C@@H]2CCC[C@H]2[C@@H]2CCCC[NH2+]2)CC1
CCC1CCC(C[NH2+][C@@H]2CCC[C@H]2[C@@H]2CCCC[NH2+]2)CC1
C=CCCC1CCC(C[NH2+][C@@H]2CCC[C@H]2[C@@H]2CCCC[NH2+]2)CC1
102
{ "fragment_index": 0, "new_substring": "C=CCC&", "old_substring": "CC5" }
Can you make molecule CCC1CCC(C[NH2+][C@@H]2CCC[C@H]2[C@@H]2CCCC[NH2+]2)CC1 less soluble in water? The output molecule should be similar to the input molecule.
ClCCCC1CCC(C[NH2+][C@@H]2CCC[C@H]2[C@@H]2CCCC[NH2+]2)CC1
CCC1CCC(C[NH2+][C@@H]2CCC[C@H]2[C@@H]2CCCC[NH2+]2)CC1
ClCCCC1CCC(C[NH2+][C@@H]2CCC[C@H]2[C@@H]2CCCC[NH2+]2)CC1
102
{ "fragment_index": 0, "new_substring": "C&CCCl", "old_substring": "CC5" }
Can you make molecule CCC1CCC(C[NH2+][C@@H]2CCC[C@H]2[C@@H]2CCCC[NH2+]2)CC1 less soluble in water? The output molecule should be similar to the input molecule.
SCCCCC1CCC(C[NH2+][C@@H]2CCC[C@H]2[C@@H]2CCCC[NH2+]2)CC1
CCC1CCC(C[NH2+][C@@H]2CCC[C@H]2[C@@H]2CCCC[NH2+]2)CC1
SCCCCC1CCC(C[NH2+][C@@H]2CCC[C@H]2[C@@H]2CCCC[NH2+]2)CC1
102
{ "fragment_index": 0, "new_substring": "C&CCCS", "old_substring": "CC5" }
Can you make molecule CCC1CCC(C[NH2+][C@@H]2CCC[C@H]2[C@@H]2CCCC[NH2+]2)CC1 less soluble in water? The output molecule should be similar to the input molecule.
CC(Br)=C1CCC(C[NH2+][C@@H]2CCC[C@H]2[C@@H]2CCCC[NH2+]2)CC1
CCC1CCC(C[NH2+][C@@H]2CCC[C@H]2[C@@H]2CCCC[NH2+]2)CC1
CC(Br)=C1CCC(C[NH2+][C@@H]2CCC[C@H]2[C@@H]2CCCC[NH2+]2)CC1
102
{ "fragment_index": 0, "new_substring": "CC=&Br", "old_substring": "CC5" }
Can you make molecule CCCn1c(=C(C#N)C#N)s/c(=C/c2ccccn2)c1=O less soluble in water? The output molecule should be similar to the input molecule.
CC1CC(n2c(=C(C#N)C#N)s/c(=C/c3ccccn3)c2=O)C1
CCCn1c(=C(C#N)C#N)s/c(=C/c2ccccn2)c1=O
CC1CC(n2c(=C(C#N)C#N)s/c(=C/c3ccccn3)c2=O)C1
102
{ "fragment_index": 0, "new_substring": "CC1CC&C1", "old_substring": "CCC3" }
Can you make molecule CCCn1c(=C(C#N)C#N)s/c(=C/c2ccccn2)c1=O less soluble in water? The output molecule should be similar to the input molecule.
CC(C)CCn1c(=C(C#N)C#N)s/c(=C/c2ccccn2)c1=O
CCCn1c(=C(C#N)C#N)s/c(=C/c2ccccn2)c1=O
CC(C)CCn1c(=C(C#N)C#N)s/c(=C/c2ccccn2)c1=O
102
{ "fragment_index": 0, "new_substring": "CC(C)CC&", "old_substring": "CCC3" }
Can you make molecule CCCn1c(=C(C#N)C#N)s/c(=C/c2ccccn2)c1=O less soluble in water? The output molecule should be similar to the input molecule.
N#CC(C#N)=c1s/c(=C/c2ccccn2)c(=O)n1CCCCBr
CCCn1c(=C(C#N)C#N)s/c(=C/c2ccccn2)c1=O
N#CC(C#N)=c1s/c(=C/c2ccccn2)c(=O)n1CCCCBr
102
{ "fragment_index": 0, "new_substring": "C&CCCBr", "old_substring": "CCC3" }
Can you make molecule CCCn1c(=C(C#N)C#N)s/c(=C/c2ccccn2)c1=O less soluble in water? The output molecule should be similar to the input molecule.
C=CCCCn1c(=C(C#N)C#N)s/c(=C/c2ccccn2)c1=O
CCCn1c(=C(C#N)C#N)s/c(=C/c2ccccn2)c1=O
C=CCCCn1c(=C(C#N)C#N)s/c(=C/c2ccccn2)c1=O
102
{ "fragment_index": 0, "new_substring": "C=CCCC&", "old_substring": "CCC3" }
Can you make molecule CCCn1c(=C(C#N)C#N)s/c(=C/c2ccccn2)c1=O less soluble in water? The output molecule should be similar to the input molecule.
N#CC(C#N)=c1s/c(=C/c2ccccn2)c(=O)n1CCCCCl
CCCn1c(=C(C#N)C#N)s/c(=C/c2ccccn2)c1=O
N#CC(C#N)=c1s/c(=C/c2ccccn2)c(=O)n1CCCCCl
102
{ "fragment_index": 0, "new_substring": "C&CCCCl", "old_substring": "CCC3" }
Can you make molecule CC(C)N(CC(N)=O)C(=O)c1ccc2cc[nH]c2c1 less soluble in water? The output molecule should be similar to the input molecule.
CC(C)C1(CC(N)=O)CCN(C(=O)c2ccc3cc[nH]c3c2)C1
CC(C)N(CC(N)=O)C(=O)c1ccc2cc[nH]c2c1
CC(C)C1(CC(N)=O)CCN(C(=O)c2ccc3cc[nH]c3c2)C1
102
{ "fragment_index": 0, "new_substring": "N1&CCC&&C1", "old_substring": "N345" }
Can you make molecule CC(C)N(CC(N)=O)C(=O)c1ccc2cc[nH]c2c1 less soluble in water? The output molecule should be similar to the input molecule.
CC(C)C1(CC(N)=O)CCCN(C(=O)c2ccc3cc[nH]c3c2)C1
CC(C)N(CC(N)=O)C(=O)c1ccc2cc[nH]c2c1
CC(C)C1(CC(N)=O)CCCN(C(=O)c2ccc3cc[nH]c3c2)C1
102
{ "fragment_index": 0, "new_substring": "N1&CCCC&&C1", "old_substring": "N345" }
Can you make molecule CC(C)N(CC(N)=O)C(=O)c1ccc2cc[nH]c2c1 less soluble in water? The output molecule should be similar to the input molecule.
CC(C)c1oc(C(=O)c2ccc3cc[nH]c3c2)c(C#N)c1CC(N)=O
CC(C)N(CC(N)=O)C(=O)c1ccc2cc[nH]c2c1
CC(C)c1oc(C(=O)c2ccc3cc[nH]c3c2)c(C#N)c1CC(N)=O
102
{ "fragment_index": 0, "new_substring": "N#Cc1c&oc&c1&", "old_substring": "N345" }
Can you make molecule CC(C)N(CC(N)=O)C(=O)c1ccc2cc[nH]c2c1 less soluble in water? The output molecule should be similar to the input molecule.
CC(C)C1(CC(N)=O)CCC(=O)N(C(=O)c2ccc3cc[nH]c3c2)C1
CC(C)N(CC(N)=O)C(=O)c1ccc2cc[nH]c2c1
CC(C)C1(CC(N)=O)CCC(=O)N(C(=O)c2ccc3cc[nH]c3c2)C1
102
{ "fragment_index": 0, "new_substring": "N1&CC&&CCC1=O", "old_substring": "N345" }
Can you make molecule CC(C)N(CC(N)=O)C(=O)c1ccc2cc[nH]c2c1 less soluble in water? The output molecule should be similar to the input molecule.
CC(C)[C@@]1(CC(N)=O)CCCN(C(=O)c2ccc3cc[nH]c3c2)C1
CC(C)N(CC(N)=O)C(=O)c1ccc2cc[nH]c2c1
CC(C)[C@@]1(CC(N)=O)CCCN(C(=O)c2ccc3cc[nH]c3c2)C1
102
{ "fragment_index": 0, "new_substring": "N1&CCC[C@@]&&C1", "old_substring": "N345" }
Can you make molecule C[NH2+]C[C@H](C)C(=O)Nc1snc(C)c1C(=O)[O-] less soluble in water? The output molecule should be similar to the input molecule.
C[C@H]1CC2CC[NH+](CC2)CC1=O.Cc1nsc(N)c1C(=O)[O-]
C[NH2+]C[C@H](C)C(=O)Nc1snc(C)c1C(=O)[O-]
C[C@H]1CC2CC[NH+](CC2)CC1=O.Cc1nsc(N)c1C(=O)[O-]
102
{ "fragment_index": 0, "new_substring": "C&[NH+]1CCC&CC1", "old_substring": "C[NH2+]3" }
Can you make molecule C[NH2+]C[C@H](C)C(=O)Nc1snc(C)c1C(=O)[O-] less soluble in water? The output molecule should be similar to the input molecule.
C[C@H]1C[NH+]2CCC=C(CC1=O)C2.Cc1nsc(N)c1C(=O)[O-]
C[NH2+]C[C@H](C)C(=O)Nc1snc(C)c1C(=O)[O-]
C[C@H]1C[NH+]2CCC=C(CC1=O)C2.Cc1nsc(N)c1C(=O)[O-]
102
{ "fragment_index": 0, "new_substring": "C&C1=CCC[NH+]&C1", "old_substring": "C[NH2+]3" }
Can you make molecule C[NH2+]C[C@H](C)C(=O)Nc1snc(C)c1C(=O)[O-] less soluble in water? The output molecule should be similar to the input molecule.
C[C@H]1C[NH+]2CCC(C)(CC2)C1=O.Cc1nsc(N)c1C(=O)[O-]
C[NH2+]C[C@H](C)C(=O)Nc1snc(C)c1C(=O)[O-]
C[C@H]1C[NH+]2CCC(C)(CC2)C1=O.Cc1nsc(N)c1C(=O)[O-]
102
{ "fragment_index": 0, "new_substring": "C1&(C)CC[NH+]&CC1", "old_substring": "C[NH2+]3" }
Can you make molecule C[NH2+]C[C@H](C)C(=O)Nc1snc(C)c1C(=O)[O-] less soluble in water? The output molecule should be similar to the input molecule.
C[C@H]1CC2(C)CC[NH+](CC2)CC1=O.Cc1nsc(N)c1C(=O)[O-]
C[NH2+]C[C@H](C)C(=O)Nc1snc(C)c1C(=O)[O-]
C[C@H]1CC2(C)CC[NH+](CC2)CC1=O.Cc1nsc(N)c1C(=O)[O-]
102
{ "fragment_index": 0, "new_substring": "C&[NH+]1CCC&(C)CC1", "old_substring": "C[NH2+]3" }
Can you make molecule C[NH2+]C[C@H](C)C(=O)Nc1snc(C)c1C(=O)[O-] less soluble in water? The output molecule should be similar to the input molecule.
C[C@H]1CC2CC[NH+](CC2)C1=O.Cc1nsc(N)c1C(=O)[O-]
C[NH2+]C[C@H](C)C(=O)Nc1snc(C)c1C(=O)[O-]
C[C@H]1CC2CC[NH+](CC2)C1=O.Cc1nsc(N)c1C(=O)[O-]
102
{ "fragment_index": 0, "new_substring": "[NH+]1&CCC&CC1", "old_substring": "C[NH2+]3" }
Can you make molecule Cc1ccc(Cl)cc1NCC(=O)Nc1cccc(S(=O)(=O)N2CCCC2)c1 less soluble in water? The output molecule should be similar to the input molecule.
Cc1ccc(Cl)cc1NCCC(CO)=Nc1cccc(S(=O)(=O)N2CCCC2)c1
Cc1ccc(Cl)cc1NCC(=O)Nc1cccc(S(=O)(=O)N2CCCC2)c1
Cc1ccc(Cl)cc1NCCC(CO)=Nc1cccc(S(=O)(=O)N2CCCC2)c1
102
{ "fragment_index": 0, "new_substring": "C&CC=&CO", "old_substring": "C4C3=O" }
Can you make molecule Cc1ccc(Cl)cc1NCC(=O)Nc1cccc(S(=O)(=O)N2CCCC2)c1 less soluble in water? The output molecule should be similar to the input molecule.
C/C(CNc1cc(Cl)ccc1C)=N/ONc1cccc(S(=O)(=O)N2CCCC2)c1
Cc1ccc(Cl)cc1NCC(=O)Nc1cccc(S(=O)(=O)N2CCCC2)c1
C/C(CNc1cc(Cl)ccc1C)=N/ONc1cccc(S(=O)(=O)N2CCCC2)c1
102
{ "fragment_index": 0, "new_substring": "C/C(C&)=N/O&", "old_substring": "C4C3=O" }
Can you make molecule Cc1ccc(Cl)cc1NCC(=O)Nc1cccc(S(=O)(=O)N2CCCC2)c1 less soluble in water? The output molecule should be similar to the input molecule.
CCC(CC)(Nc1cc(Cl)ccc1C)C(=O)CNc1cccc(S(=O)(=O)N2CCCC2)c1
Cc1ccc(Cl)cc1NCC(=O)Nc1cccc(S(=O)(=O)N2CCCC2)c1
CCC(CC)(Nc1cc(Cl)ccc1C)C(=O)CNc1cccc(S(=O)(=O)N2CCCC2)c1
102
{ "fragment_index": 0, "new_substring": "CCC&(CC)C(=O)C&", "old_substring": "C4C3=O" }
Can you make molecule Cc1ccc(Cl)cc1NCC(=O)Nc1cccc(S(=O)(=O)N2CCCC2)c1 less soluble in water? The output molecule should be similar to the input molecule.
Cc1ccc(Cl)cc1NSSC(=O)Nc1cccc(S(=O)(=O)N2CCCC2)c1
Cc1ccc(Cl)cc1NCC(=O)Nc1cccc(S(=O)(=O)N2CCCC2)c1
Cc1ccc(Cl)cc1NSSC(=O)Nc1cccc(S(=O)(=O)N2CCCC2)c1
102
{ "fragment_index": 0, "new_substring": "S&SC&=O", "old_substring": "C4C3=O" }
Can you make molecule Cc1ccc(Cl)cc1NCC(=O)Nc1cccc(S(=O)(=O)N2CCCC2)c1 less soluble in water? The output molecule should be similar to the input molecule.
CCC(CC)(Nc1cc(Cl)ccc1C)C(=O)CCNc1cccc(S(=O)(=O)N2CCCC2)c1
Cc1ccc(Cl)cc1NCC(=O)Nc1cccc(S(=O)(=O)N2CCCC2)c1
CCC(CC)(Nc1cc(Cl)ccc1C)C(=O)CCNc1cccc(S(=O)(=O)N2CCCC2)c1
102
{ "fragment_index": 0, "new_substring": "CCC&(CC)C(=O)CC&", "old_substring": "C4C3=O" }
Can you make molecule CSCc1ccnc(NC2CCN(C(=O)c3cnccn3)CC2)c1 less soluble in water? The output molecule should be similar to the input molecule.
CSCc1ccnc(NC2CCC(C(=O)c3cnccn3)CC2)c1
CSCc1ccnc(NC2CCN(C(=O)c3cnccn3)CC2)c1
CSCc1ccnc(NC2CCC(C(=O)c3cnccn3)CC2)c1
102
{ "fragment_index": 0, "new_substring": "C1&CCC&CC1", "old_substring": "C17CCN4CC1" }
Can you make molecule CSCc1ccnc(NC2CCN(C(=O)c3cnccn3)CC2)c1 less soluble in water? The output molecule should be similar to the input molecule.
CSCc1ccnc(NC2CCC(C)(C(=O)c3cnccn3)CC2)c1
CSCc1ccnc(NC2CCN(C(=O)c3cnccn3)CC2)c1
CSCc1ccnc(NC2CCC(C)(C(=O)c3cnccn3)CC2)c1
102
{ "fragment_index": 0, "new_substring": "C1&CCC&(C)CC1", "old_substring": "C17CCN4CC1" }
Can you make molecule CSCc1ccnc(NC2CCN(C(=O)c3cnccn3)CC2)c1 less soluble in water? The output molecule should be similar to the input molecule.
CSCc1ccnc(NC2(C#N)CCC(C(=O)c3cnccn3)CC2)c1
CSCc1ccnc(NC2CCN(C(=O)c3cnccn3)CC2)c1
CSCc1ccnc(NC2(C#N)CCC(C(=O)c3cnccn3)CC2)c1
102
{ "fragment_index": 0, "new_substring": "C1&(C#N)CCC&CC1", "old_substring": "C17CCN4CC1" }
Can you make molecule CSCc1ccnc(NC2CCN(C(=O)c3cnccn3)CC2)c1 less soluble in water? The output molecule should be similar to the input molecule.
CSCc1ccnc(NCCCCCC(=O)c2cnccn2)c1
CSCc1ccnc(NC2CCN(C(=O)c3cnccn3)CC2)c1
CSCc1ccnc(NCCCCCC(=O)c2cnccn2)c1
102
{ "fragment_index": 0, "new_substring": "C&CCCC&", "old_substring": "C17CCN4CC1" }
Can you make molecule CSCc1ccnc(NC2CCN(C(=O)c3cnccn3)CC2)c1 less soluble in water? The output molecule should be similar to the input molecule.
CSCc1ccnc(NN2CCC=C(CC(=O)c3cnccn3)C2)c1
CSCc1ccnc(NC2CCN(C(=O)c3cnccn3)CC2)c1
CSCc1ccnc(NN2CCC=C(CC(=O)c3cnccn3)C2)c1
102
{ "fragment_index": 0, "new_substring": "N1&CCC=C(C&)C1", "old_substring": "C17CCN4CC1" }
Can you make molecule C[NH+](Cc1c[nH]nc1-c1ccccc1)C[C@@H](O)CN1CCOCC1 less soluble in water? The output molecule should be similar to the input molecule.
C[NH+](Cc1c[nH]nc1-c1ccccc1)C[C@@H](O)C(C)(C)N1CCOCC1
C[NH+](Cc1c[nH]nc1-c1ccccc1)C[C@@H](O)CN1CCOCC1
C[NH+](Cc1c[nH]nc1-c1ccccc1)C[C@@H](O)C(C)(C)N1CCOCC1
102
{ "fragment_index": 0, "new_substring": "C&[C@@H](O)C&(C)C", "old_substring": "C3[C@@H](O)C4" }
Can you make molecule C[NH+](Cc1c[nH]nc1-c1ccccc1)C[C@@H](O)CN1CCOCC1 less soluble in water? The output molecule should be similar to the input molecule.
C[C@H](C[NH+](C)Cc1c[nH]nc1-c1ccccc1)C(=O)N1CCOCC1
C[NH+](Cc1c[nH]nc1-c1ccccc1)C[C@@H](O)CN1CCOCC1
C[C@H](C[NH+](C)Cc1c[nH]nc1-c1ccccc1)C(=O)N1CCOCC1
102
{ "fragment_index": 0, "new_substring": "C&[C@@H](C)C&=O", "old_substring": "C3[C@@H](O)C4" }
Can you make molecule C[NH+](Cc1c[nH]nc1-c1ccccc1)C[C@@H](O)CN1CCOCC1 less soluble in water? The output molecule should be similar to the input molecule.
C[NH+](Cc1c[nH]nc1-c1ccccc1)C[C@H](S)CN1CCOCC1
C[NH+](Cc1c[nH]nc1-c1ccccc1)C[C@@H](O)CN1CCOCC1
C[NH+](Cc1c[nH]nc1-c1ccccc1)C[C@H](S)CN1CCOCC1
102
{ "fragment_index": 0, "new_substring": "C&[C@H](S)C&", "old_substring": "C3[C@@H](O)C4" }
Can you make molecule C[NH+](Cc1c[nH]nc1-c1ccccc1)C[C@@H](O)CN1CCOCC1 less soluble in water? The output molecule should be similar to the input molecule.
C[C@@H](CC[NH+](C)Cc1c[nH]nc1-c1ccccc1)CC(=O)N1CCOCC1
C[NH+](Cc1c[nH]nc1-c1ccccc1)C[C@@H](O)CN1CCOCC1
C[C@@H](CC[NH+](C)Cc1c[nH]nc1-c1ccccc1)CC(=O)N1CCOCC1
102
{ "fragment_index": 0, "new_substring": "C[C@@H](CC&)CC&=O", "old_substring": "C3[C@@H](O)C4" }
Can you make molecule C[NH+](Cc1c[nH]nc1-c1ccccc1)C[C@@H](O)CN1CCOCC1 less soluble in water? The output molecule should be similar to the input molecule.
C[C@@H](CC(=O)[NH+](C)Cc1c[nH]nc1-c1ccccc1)C(=O)N1CCOCC1
C[NH+](Cc1c[nH]nc1-c1ccccc1)C[C@@H](O)CN1CCOCC1
C[C@@H](CC(=O)[NH+](C)Cc1c[nH]nc1-c1ccccc1)C(=O)N1CCOCC1
102
{ "fragment_index": 0, "new_substring": "C[C@@H](CC&=O)C&=O", "old_substring": "C3[C@@H](O)C4" }
Can you make molecule CC[C@H]1NC(=O)[C@H](CC)N(Cc2cscc2C)C1=O less soluble in water? The output molecule should be similar to the input molecule.
C=CCC[C@H]1NC(=O)[C@H](CC)N(Cc2cscc2C)C1=O
CC[C@H]1NC(=O)[C@H](CC)N(Cc2cscc2C)C1=O
C=CCC[C@H]1NC(=O)[C@H](CC)N(Cc2cscc2C)C1=O
102
{ "fragment_index": 0, "new_substring": "C=CCC&", "old_substring": "C4C" }
Can you make molecule CC[C@H]1NC(=O)[C@H](CC)N(Cc2cscc2C)C1=O less soluble in water? The output molecule should be similar to the input molecule.
CC[C@H]1C(=O)N[C@H](CCCCl)C(=O)N1Cc1cscc1C
CC[C@H]1NC(=O)[C@H](CC)N(Cc2cscc2C)C1=O
CC[C@H]1C(=O)N[C@H](CCCCl)C(=O)N1Cc1cscc1C
102
{ "fragment_index": 0, "new_substring": "C&CCCl", "old_substring": "C4C" }
Can you make molecule CC[C@H]1NC(=O)[C@H](CC)N(Cc2cscc2C)C1=O less soluble in water? The output molecule should be similar to the input molecule.
CC[C@H]1C(=O)N[C@H](CCCCS)C(=O)N1Cc1cscc1C
CC[C@H]1NC(=O)[C@H](CC)N(Cc2cscc2C)C1=O
CC[C@H]1C(=O)N[C@H](CCCCS)C(=O)N1Cc1cscc1C
102
{ "fragment_index": 0, "new_substring": "C&CCCS", "old_substring": "C4C" }
Can you make molecule CC[C@H]1NC(=O)[C@H](CC)N(Cc2cscc2C)C1=O less soluble in water? The output molecule should be similar to the input molecule.
CC[C@H]1C(=O)N[C@H](CCCBr)C(=O)N1Cc1cscc1C
CC[C@H]1NC(=O)[C@H](CC)N(Cc2cscc2C)C1=O
CC[C@H]1C(=O)N[C@H](CCCBr)C(=O)N1Cc1cscc1C
102
{ "fragment_index": 0, "new_substring": "C&CCBr", "old_substring": "C4C" }
Can you make molecule CC[C@H]1NC(=O)[C@H](CC)N(Cc2cscc2C)C1=O less soluble in water? The output molecule should be similar to the input molecule.
CC[C@H]1C(=O)N[C@H](CCCCF)C(=O)N1Cc1cscc1C
CC[C@H]1NC(=O)[C@H](CC)N(Cc2cscc2C)C1=O
CC[C@H]1C(=O)N[C@H](CCCCF)C(=O)N1Cc1cscc1C
102
{ "fragment_index": 0, "new_substring": "C&CCCF", "old_substring": "C4C" }
Can you make molecule CC(=CC(=O)NC[C@H]1CCCO1)NNC(=O)Cc1cccc2ccccc12 less soluble in water? The output molecule should be similar to the input molecule.
CC(=CC(=O)C=NC[C@H]1CCCO1)NNC(=O)Cc1cccc2ccccc12
CC(=CC(=O)NC[C@H]1CCCO1)NNC(=O)Cc1cccc2ccccc12
CC(=CC(=O)C=NC[C@H]1CCCO1)NNC(=O)Cc1cccc2ccccc12
102
{ "fragment_index": 0, "new_substring": "C=&C(=O)C=&", "old_substring": "C=5C3=O" }
Can you make molecule CC(=CC(=O)NC[C@H]1CCCO1)NNC(=O)Cc1cccc2ccccc12 less soluble in water? The output molecule should be similar to the input molecule.
C=C(C=C(C)NNC(=O)Cc1cccc2ccccc12)C(=O)NC[C@H]1CCCO1
CC(=CC(=O)NC[C@H]1CCCO1)NNC(=O)Cc1cccc2ccccc12
C=C(C=C(C)NNC(=O)Cc1cccc2ccccc12)C(=O)NC[C@H]1CCCO1
102
{ "fragment_index": 0, "new_substring": "C=C(C&)C&=O", "old_substring": "C=5C3=O" }
Can you make molecule CC(=CC(=O)NC[C@H]1CCCO1)NNC(=O)Cc1cccc2ccccc12 less soluble in water? The output molecule should be similar to the input molecule.
CC(NNC(=O)Cc1cccc2ccccc12)=[SH]C1=NC(=O)C(=NC[C@H]2CCCO2)S1
CC(=CC(=O)NC[C@H]1CCCO1)NNC(=O)Cc1cccc2ccccc12
CC(NNC(=O)Cc1cccc2ccccc12)=[SH]C1=NC(=O)C(=NC[C@H]2CCCO2)S1
102
{ "fragment_index": 0, "new_substring": "S&C1=NC(=O)C=&S1", "old_substring": "C=5C3=O" }
Can you make molecule CC(=CC(=O)NC[C@H]1CCCO1)NNC(=O)Cc1cccc2ccccc12 less soluble in water? The output molecule should be similar to the input molecule.
CC(NNC(=O)Cc1cccc2ccccc12)=[SH]C1=NC(=NC[C@H]2CCCO2)C(=O)S1
CC(=CC(=O)NC[C@H]1CCCO1)NNC(=O)Cc1cccc2ccccc12
CC(NNC(=O)Cc1cccc2ccccc12)=[SH]C1=NC(=NC[C@H]2CCCO2)C(=O)S1
102
{ "fragment_index": 0, "new_substring": "S&C1=NC=&C(=O)S1", "old_substring": "C=5C3=O" }
Can you make molecule CC(=CC(=O)NC[C@H]1CCCO1)NNC(=O)Cc1cccc2ccccc12 less soluble in water? The output molecule should be similar to the input molecule.
CC(=CCCC(C)=NC[C@H]1CCCO1)NNC(=O)Cc1cccc2ccccc12
CC(=CC(=O)NC[C@H]1CCCO1)NNC(=O)Cc1cccc2ccccc12
CC(=CCCC(C)=NC[C@H]1CCCO1)NNC(=O)Cc1cccc2ccccc12
102
{ "fragment_index": 0, "new_substring": "C=&CCC=&C", "old_substring": "C=5C3=O" }
Can you make molecule COc1ccc(-n2nc(C(=O)N[C@H](C)[C@H](CO)SC)cc2C)cc1 less soluble in water? The output molecule should be similar to the input molecule.
COc1ccc(-n2nc(C(=O)N[C@H](C)[C@H](CO)SC)c(Cl)c2C)cc1
COc1ccc(-n2nc(C(=O)N[C@H](C)[C@H](CO)SC)cc2C)cc1
COc1ccc(-n2nc(C(=O)N[C@H](C)[C@H](CO)SC)c(Cl)c2C)cc1
102
{ "fragment_index": 0, "new_substring": "n1&nc&c(Cl)c1C", "old_substring": "n18nc7cc1C" }
Can you make molecule COc1ccc(-n2nc(C(=O)N[C@H](C)[C@H](CO)SC)cc2C)cc1 less soluble in water? The output molecule should be similar to the input molecule.
COc1ccc(-n2ccn(C(=O)N[C@H](C)[C@H](CO)SC)c2=S)cc1
COc1ccc(-n2nc(C(=O)N[C@H](C)[C@H](CO)SC)cc2C)cc1
COc1ccc(-n2ccn(C(=O)N[C@H](C)[C@H](CO)SC)c2=S)cc1
102
{ "fragment_index": 0, "new_substring": "n1&ccn&c1=S", "old_substring": "n18nc7cc1C" }
Can you make molecule COc1ccc(-n2nc(C(=O)N[C@H](C)[C@H](CO)SC)cc2C)cc1 less soluble in water? The output molecule should be similar to the input molecule.
COc1ccc(-n2ncc(C(=O)N[C@H](C)[C@H](CO)SC)c(Cl)c2=O)cc1
COc1ccc(-n2nc(C(=O)N[C@H](C)[C@H](CO)SC)cc2C)cc1
COc1ccc(-n2ncc(C(=O)N[C@H](C)[C@H](CO)SC)c(Cl)c2=O)cc1
102
{ "fragment_index": 0, "new_substring": "n1&ncc&c(Cl)c1=O", "old_substring": "n18nc7cc1C" }
Can you make molecule COc1ccc(-n2nc(C(=O)N[C@H](C)[C@H](CO)SC)cc2C)cc1 less soluble in water? The output molecule should be similar to the input molecule.
COc1ccc(-n2cc(C(=O)N[C@H](C)[C@H](CO)SC)c(=O)cc2C)cc1
COc1ccc(-n2nc(C(=O)N[C@H](C)[C@H](CO)SC)cc2C)cc1
COc1ccc(-n2cc(C(=O)N[C@H](C)[C@H](CO)SC)c(=O)cc2C)cc1
102
{ "fragment_index": 0, "new_substring": "n1&cc&c(=O)cc1C", "old_substring": "n18nc7cc1C" }
Can you make molecule COc1ccc(-n2nc(C(=O)N[C@H](C)[C@H](CO)SC)cc2C)cc1 less soluble in water? The output molecule should be similar to the input molecule.
COc1ccc(-n2cc(C(=O)N[C@H](C)[C@H](CO)SC)cc2Br)cc1
COc1ccc(-n2nc(C(=O)N[C@H](C)[C@H](CO)SC)cc2C)cc1
COc1ccc(-n2cc(C(=O)N[C@H](C)[C@H](CO)SC)cc2Br)cc1
102
{ "fragment_index": 0, "new_substring": "n1&cc&cc1Br", "old_substring": "n18nc7cc1C" }
Can you make molecule Cc1nc(C)c(C(=O)Nc2ccc(Oc3ccccc3)cn2)o1 less soluble in water? The output molecule should be similar to the input molecule.
Cc1nc(C)c(CC(=O)SNc2ccc(Oc3ccccc3)cn2)o1
Cc1nc(C)c(C(=O)Nc2ccc(Oc3ccccc3)cn2)o1
Cc1nc(C)c(CC(=O)SNc2ccc(Oc3ccccc3)cn2)o1
102
{ "fragment_index": 0, "new_substring": "S&C(=O)C&", "old_substring": "C48=O" }
Can you make molecule Cc1nc(C)c(C(=O)Nc2ccc(Oc3ccccc3)cn2)o1 less soluble in water? The output molecule should be similar to the input molecule.
Cc1nc(C)c(C(=O)CCCC(=O)Nc2ccc(Oc3ccccc3)cn2)o1
Cc1nc(C)c(C(=O)Nc2ccc(Oc3ccccc3)cn2)o1
Cc1nc(C)c(C(=O)CCCC(=O)Nc2ccc(Oc3ccccc3)cn2)o1
102
{ "fragment_index": 0, "new_substring": "C&(=O)CCCC&=O", "old_substring": "C48=O" }
Can you make molecule Cc1nc(C)c(C(=O)Nc2ccc(Oc3ccccc3)cn2)o1 less soluble in water? The output molecule should be similar to the input molecule.
Cc1nc(C)c(C(C)(C)CC(=O)Nc2ccc(Oc3ccccc3)cn2)o1
Cc1nc(C)c(C(=O)Nc2ccc(Oc3ccccc3)cn2)o1
Cc1nc(C)c(C(C)(C)CC(=O)Nc2ccc(Oc3ccccc3)cn2)o1
102
{ "fragment_index": 0, "new_substring": "C&(=O)CC&(C)C", "old_substring": "C48=O" }
Can you make molecule Cc1nc(C)c(C(=O)Nc2ccc(Oc3ccccc3)cn2)o1 less soluble in water? The output molecule should be similar to the input molecule.
Cc1nc(C)c(C(C)(C)CCC(=O)Nc2ccc(Oc3ccccc3)cn2)o1
Cc1nc(C)c(C(=O)Nc2ccc(Oc3ccccc3)cn2)o1
Cc1nc(C)c(C(C)(C)CCC(=O)Nc2ccc(Oc3ccccc3)cn2)o1
102
{ "fragment_index": 0, "new_substring": "C&(=O)CCC&(C)C", "old_substring": "C48=O" }
Can you make molecule Cc1nc(C)c(C(=O)Nc2ccc(Oc3ccccc3)cn2)o1 less soluble in water? The output molecule should be similar to the input molecule.
Cc1nc(C)c([C@H](C)C(=O)SNc2ccc(Oc3ccccc3)cn2)o1
Cc1nc(C)c(C(=O)Nc2ccc(Oc3ccccc3)cn2)o1
Cc1nc(C)c([C@H](C)C(=O)SNc2ccc(Oc3ccccc3)cn2)o1
102
{ "fragment_index": 0, "new_substring": "S&C(=O)[C@H]&C", "old_substring": "C48=O" }
Can you make molecule Cc1ccc(N2C[C@@H](C(=O)Nc3nnc(-c4sc(C)nc4C)o3)CC2=O)cc1 less soluble in water? The output molecule should be similar to the input molecule.
Cc1ccc(N2C[C@@H](C(=O)Nc3nc(-c4sc(C)nc4C)co3)CC2=O)cc1
Cc1ccc(N2C[C@@H](C(=O)Nc3nnc(-c4sc(C)nc4C)o3)CC2=O)cc1
Cc1ccc(N2C[C@@H](C(=O)Nc3nc(-c4sc(C)nc4C)co3)CC2=O)cc1
102
{ "fragment_index": 0, "new_substring": "c1&nc&co1", "old_substring": "c16nnc9o1" }
Can you make molecule Cc1ccc(N2C[C@@H](C(=O)Nc3nnc(-c4sc(C)nc4C)o3)CC2=O)cc1 less soluble in water? The output molecule should be similar to the input molecule.
Cc1ccc(N2C[C@@H](C(=O)Nc3nn(-c4sc(C)nc4C)c(=S)o3)CC2=O)cc1
Cc1ccc(N2C[C@@H](C(=O)Nc3nnc(-c4sc(C)nc4C)o3)CC2=O)cc1
Cc1ccc(N2C[C@@H](C(=O)Nc3nn(-c4sc(C)nc4C)c(=S)o3)CC2=O)cc1
102
{ "fragment_index": 0, "new_substring": "c1&nn&c(=S)o1", "old_substring": "c16nnc9o1" }
Can you make molecule Cc1ccc(N2C[C@@H](C(=O)Nc3nnc(-c4sc(C)nc4C)o3)CC2=O)cc1 less soluble in water? The output molecule should be similar to the input molecule.
Cc1ccc(N2C[C@@H](C(=O)Nc3cc(-c4sc(C)nc4C)on3)CC2=O)cc1
Cc1ccc(N2C[C@@H](C(=O)Nc3nnc(-c4sc(C)nc4C)o3)CC2=O)cc1
Cc1ccc(N2C[C@@H](C(=O)Nc3cc(-c4sc(C)nc4C)on3)CC2=O)cc1
102
{ "fragment_index": 0, "new_substring": "c1&cc&on1", "old_substring": "c16nnc9o1" }
Can you make molecule Cc1ccc(N2C[C@@H](C(=O)Nc3nnc(-c4sc(C)nc4C)o3)CC2=O)cc1 less soluble in water? The output molecule should be similar to the input molecule.
Cc1ccc(N2C[C@@H](C(=O)Nc3nc(C)c(-c4sc(C)nc4C)o3)CC2=O)cc1
Cc1ccc(N2C[C@@H](C(=O)Nc3nnc(-c4sc(C)nc4C)o3)CC2=O)cc1
Cc1ccc(N2C[C@@H](C(=O)Nc3nc(C)c(-c4sc(C)nc4C)o3)CC2=O)cc1
102
{ "fragment_index": 0, "new_substring": "c1&nc(C)c&o1", "old_substring": "c16nnc9o1" }
Can you make molecule Cc1ccc(N2C[C@@H](C(=O)Nc3nnc(-c4sc(C)nc4C)o3)CC2=O)cc1 less soluble in water? The output molecule should be similar to the input molecule.
Cc1ccc(N2C[C@@H](C(=O)Nc3nn(-c4sc(C)nc4C)c(=S)s3)CC2=O)cc1
Cc1ccc(N2C[C@@H](C(=O)Nc3nnc(-c4sc(C)nc4C)o3)CC2=O)cc1
Cc1ccc(N2C[C@@H](C(=O)Nc3nn(-c4sc(C)nc4C)c(=S)s3)CC2=O)cc1
102
{ "fragment_index": 0, "new_substring": "c1&nn&c(=S)s1", "old_substring": "c16nnc9o1" }
Can you make molecule C[C@@H]1CCCN(C(=O)COc2ccc(Nc3ccccc3)cc2)C1 less soluble in water? The output molecule should be similar to the input molecule.
C[C@@H]1CCCN(SC(=O)COc2ccc(Nc3ccccc3)cc2)C1
C[C@@H]1CCCN(C(=O)COc2ccc(Nc3ccccc3)cc2)C1
C[C@@H]1CCCN(SC(=O)COc2ccc(Nc3ccccc3)cc2)C1
102
{ "fragment_index": 0, "new_substring": "S&C(=O)C&", "old_substring": "C4(=O)C5" }
Can you make molecule C[C@@H]1CCCN(C(=O)COc2ccc(Nc3ccccc3)cc2)C1 less soluble in water? The output molecule should be similar to the input molecule.
C[C@@H]1CCCN(C(=O)CCCC(=O)Oc2ccc(Nc3ccccc3)cc2)C1
C[C@@H]1CCCN(C(=O)COc2ccc(Nc3ccccc3)cc2)C1
C[C@@H]1CCCN(C(=O)CCCC(=O)Oc2ccc(Nc3ccccc3)cc2)C1
102
{ "fragment_index": 0, "new_substring": "C&(=O)CCCC&=O", "old_substring": "C4(=O)C5" }
Can you make molecule C[C@@H]1CCCN(C(=O)COc2ccc(Nc3ccccc3)cc2)C1 less soluble in water? The output molecule should be similar to the input molecule.
C[C@@H]1CCCN(C(=O)CC(C)(C)Oc2ccc(Nc3ccccc3)cc2)C1
C[C@@H]1CCCN(C(=O)COc2ccc(Nc3ccccc3)cc2)C1
C[C@@H]1CCCN(C(=O)CC(C)(C)Oc2ccc(Nc3ccccc3)cc2)C1
102
{ "fragment_index": 0, "new_substring": "C&(=O)CC&(C)C", "old_substring": "C4(=O)C5" }
Can you make molecule C[C@@H]1CCCN(C(=O)COc2ccc(Nc3ccccc3)cc2)C1 less soluble in water? The output molecule should be similar to the input molecule.
C[C@@H]1CCCN(C[S@+]([O-])CCCOc2ccc(Nc3ccccc3)cc2)C1
C[C@@H]1CCCN(C(=O)COc2ccc(Nc3ccccc3)cc2)C1
C[C@@H]1CCCN(C[S@+]([O-])CCCOc2ccc(Nc3ccccc3)cc2)C1
102
{ "fragment_index": 0, "new_substring": "C&[S@](=O)CCC&", "old_substring": "C4(=O)C5" }
Can you make molecule C[C@@H]1CCCN(C(=O)COc2ccc(Nc3ccccc3)cc2)C1 less soluble in water? The output molecule should be similar to the input molecule.
C[C@@H]1CCCN(C(=O)CCC(C)(C)Oc2ccc(Nc3ccccc3)cc2)C1
C[C@@H]1CCCN(C(=O)COc2ccc(Nc3ccccc3)cc2)C1
C[C@@H]1CCCN(C(=O)CCC(C)(C)Oc2ccc(Nc3ccccc3)cc2)C1
102
{ "fragment_index": 0, "new_substring": "C&(=O)CCC&(C)C", "old_substring": "C4(=O)C5" }
Can you make molecule COC(CNC(=O)C(=O)Nc1c2c(nn1-c1ccccc1C)CSC2)OC less soluble in water? The output molecule should be similar to the input molecule.
COc1cc2c(cc1NC(=O)C(=O)Nc1c3c(nn1-c1ccccc1C)CSC3)CC(OC)C2
COC(CNC(=O)C(=O)Nc1c2c(nn1-c1ccccc1C)CSC2)OC
COc1cc2c(cc1NC(=O)C(=O)Nc1c3c(nn1-c1ccccc1C)CSC3)CC(OC)C2
102
{ "fragment_index": 0, "new_substring": "C1&Cc2cc&c&cc2C1", "old_substring": "C56C7" }
Can you make molecule COC(CNC(=O)C(=O)Nc1c2c(nn1-c1ccccc1C)CSC2)OC less soluble in water? The output molecule should be similar to the input molecule.
CO[C@H]1CC[C@@](NC(=O)C(=O)Nc2c3c(nn2-c2ccccc2C)CSC3)(OC)C1
COC(CNC(=O)C(=O)Nc1c2c(nn1-c1ccccc1C)CSC2)OC
CO[C@H]1CC[C@@](NC(=O)C(=O)Nc2c3c(nn2-c2ccccc2C)CSC3)(OC)C1
102
{ "fragment_index": 0, "new_substring": "[C@H]1&CC[C@]&&C1", "old_substring": "C56C7" }
Can you make molecule COC(CNC(=O)C(=O)Nc1c2c(nn1-c1ccccc1C)CSC2)OC less soluble in water? The output molecule should be similar to the input molecule.
CO[C@H]1CC[C@](NC(=O)C(=O)Nc2c3c(nn2-c2ccccc2C)CSC3)(OC)C1
COC(CNC(=O)C(=O)Nc1c2c(nn1-c1ccccc1C)CSC2)OC
CO[C@H]1CC[C@](NC(=O)C(=O)Nc2c3c(nn2-c2ccccc2C)CSC3)(OC)C1
102
{ "fragment_index": 0, "new_substring": "[C@H]1&CC[C@@]&&C1", "old_substring": "C56C7" }
Can you make molecule COC(CNC(=O)C(=O)Nc1c2c(nn1-c1ccccc1C)CSC2)OC less soluble in water? The output molecule should be similar to the input molecule.
COc1sc2c(c1NC(=O)C(=O)Nc1c3c(nn1-c1ccccc1C)CSC3)CCN(OC)C2
COC(CNC(=O)C(=O)Nc1c2c(nn1-c1ccccc1C)CSC2)OC
COc1sc2c(c1NC(=O)C(=O)Nc1c3c(nn1-c1ccccc1C)CSC3)CCN(OC)C2
102
{ "fragment_index": 0, "new_substring": "N1&CCc2c(sc&c2&)C1", "old_substring": "C56C7" }
Can you make molecule COC(CNC(=O)C(=O)Nc1c2c(nn1-c1ccccc1C)CSC2)OC less soluble in water? The output molecule should be similar to the input molecule.
COCCC[C@H](OC)C(C)(C)NC(=O)C(=O)Nc1c2c(nn1-c1ccccc1C)CSC2
COC(CNC(=O)C(=O)Nc1c2c(nn1-c1ccccc1C)CSC2)OC
COCCC[C@H](OC)C(C)(C)NC(=O)C(=O)Nc1c2c(nn1-c1ccccc1C)CSC2
102
{ "fragment_index": 0, "new_substring": "[C@H]&(CCC&)C&(C)C", "old_substring": "C56C7" }
Can you make molecule CCCn1c(SCn2cc([N+](=O)[O-])cn2)nnc1-c1csc(C)c1 less soluble in water? The output molecule should be similar to the input molecule.
Cc1cc(-c2nnc(SCn3cc([N+](=O)[O-])cn3)n2C2CC(C)C2)cs1
CCCn1c(SCn2cc([N+](=O)[O-])cn2)nnc1-c1csc(C)c1
Cc1cc(-c2nnc(SCn3cc([N+](=O)[O-])cn3)n2C2CC(C)C2)cs1
102
{ "fragment_index": 0, "new_substring": "CC1CC&C1", "old_substring": "CCC3" }
Can you make molecule CCCn1c(SCn2cc([N+](=O)[O-])cn2)nnc1-c1csc(C)c1 less soluble in water? The output molecule should be similar to the input molecule.
Cc1cc(-c2nnc(SCn3cc([N+](=O)[O-])cn3)n2CCC(C)C)cs1
CCCn1c(SCn2cc([N+](=O)[O-])cn2)nnc1-c1csc(C)c1
Cc1cc(-c2nnc(SCn3cc([N+](=O)[O-])cn3)n2CCC(C)C)cs1
102
{ "fragment_index": 0, "new_substring": "CC(C)CC&", "old_substring": "CCC3" }
Can you make molecule CCCn1c(SCn2cc([N+](=O)[O-])cn2)nnc1-c1csc(C)c1 less soluble in water? The output molecule should be similar to the input molecule.
Cc1cc(-c2nnc(SCn3cc([N+](=O)[O-])cn3)n2CCCCBr)cs1
CCCn1c(SCn2cc([N+](=O)[O-])cn2)nnc1-c1csc(C)c1
Cc1cc(-c2nnc(SCn3cc([N+](=O)[O-])cn3)n2CCCCBr)cs1
102
{ "fragment_index": 0, "new_substring": "C&CCCBr", "old_substring": "CCC3" }
Can you make molecule CCCn1c(SCn2cc([N+](=O)[O-])cn2)nnc1-c1csc(C)c1 less soluble in water? The output molecule should be similar to the input molecule.
C=CCCCn1c(SCn2cc([N+](=O)[O-])cn2)nnc1-c1csc(C)c1
CCCn1c(SCn2cc([N+](=O)[O-])cn2)nnc1-c1csc(C)c1
C=CCCCn1c(SCn2cc([N+](=O)[O-])cn2)nnc1-c1csc(C)c1
102
{ "fragment_index": 0, "new_substring": "C=CCCC&", "old_substring": "CCC3" }
Can you make molecule CCCn1c(SCn2cc([N+](=O)[O-])cn2)nnc1-c1csc(C)c1 less soluble in water? The output molecule should be similar to the input molecule.
Cc1cc(-c2nnc(SCn3cc([N+](=O)[O-])cn3)n2CCCCCl)cs1
CCCn1c(SCn2cc([N+](=O)[O-])cn2)nnc1-c1csc(C)c1
Cc1cc(-c2nnc(SCn3cc([N+](=O)[O-])cn3)n2CCCCCl)cs1
102
{ "fragment_index": 0, "new_substring": "C&CCCCl", "old_substring": "CCC3" }
Can you make molecule CCC[C@](C)(CO)NC(=O)Nc1cnn(Cc2ccc(Cl)cc2)c1 less soluble in water? The output molecule should be similar to the input molecule.
CCC[C@](C)(CO)NC(=O)Nc1cnn(Cc2ccc(Cl)cc2I)c1
CCC[C@](C)(CO)NC(=O)Nc1cnn(Cc2ccc(Cl)cc2)c1
CCC[C@](C)(CO)NC(=O)Nc1cnn(Cc2ccc(Cl)cc2I)c1
102
{ "fragment_index": 0, "new_substring": "c1&ccc(Cl)cc1I", "old_substring": "c18ccc(Cl)cc1" }
Can you make molecule CCC[C@](C)(CO)NC(=O)Nc1cnn(Cc2ccc(Cl)cc2)c1 less soluble in water? The output molecule should be similar to the input molecule.
CCC[C@](C)(CO)NC(=O)Nc1cnn(Cc2ccc(Cl)cc2Br)c1
CCC[C@](C)(CO)NC(=O)Nc1cnn(Cc2ccc(Cl)cc2)c1
CCC[C@](C)(CO)NC(=O)Nc1cnn(Cc2ccc(Cl)cc2Br)c1
102
{ "fragment_index": 0, "new_substring": "c1&ccc(Cl)cc1Br", "old_substring": "c18ccc(Cl)cc1" }
Can you make molecule CCC[C@](C)(CO)NC(=O)Nc1cnn(Cc2ccc(Cl)cc2)c1 less soluble in water? The output molecule should be similar to the input molecule.
CCC[C@](C)(CO)NC(=O)Nc1cnn(Cc2ccc(Cl)c(I)c2)c1
CCC[C@](C)(CO)NC(=O)Nc1cnn(Cc2ccc(Cl)cc2)c1
CCC[C@](C)(CO)NC(=O)Nc1cnn(Cc2ccc(Cl)c(I)c2)c1
102
{ "fragment_index": 0, "new_substring": "c1&ccc(Cl)c(I)c1", "old_substring": "c18ccc(Cl)cc1" }
Can you make molecule CCC[C@](C)(CO)NC(=O)Nc1cnn(Cc2ccc(Cl)cc2)c1 less soluble in water? The output molecule should be similar to the input molecule.
CCC[C@](C)(CO)NC(=O)Nc1cnn(Cc2cc(Cl)ccc2Cl)c1
CCC[C@](C)(CO)NC(=O)Nc1cnn(Cc2ccc(Cl)cc2)c1
CCC[C@](C)(CO)NC(=O)Nc1cnn(Cc2cc(Cl)ccc2Cl)c1
102
{ "fragment_index": 0, "new_substring": "Clc1ccc(Cl)c&c1", "old_substring": "c18ccc(Cl)cc1" }
Can you make molecule CCC[C@](C)(CO)NC(=O)Nc1cnn(Cc2ccc(Cl)cc2)c1 less soluble in water? The output molecule should be similar to the input molecule.
CCC[C@](C)(CO)NC(=O)Nc1cnn(C=Cc2ccc(Cl)cc2)c1
CCC[C@](C)(CO)NC(=O)Nc1cnn(Cc2ccc(Cl)cc2)c1
CCC[C@](C)(CO)NC(=O)Nc1cnn(C=Cc2ccc(Cl)cc2)c1
102
{ "fragment_index": 0, "new_substring": "C=&c1ccc(Cl)cc1", "old_substring": "c18ccc(Cl)cc1" }