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#CCNCC(=O)NC[C@@H](C)CO less soluble in water? The output molecule should be similar to the input molecule.
C#CCN1Cc2nc(sc2CNC[C@@H](C)CO)CC1=O
C#CCNCC(=O)NC[C@@H](C)CO
C#CCN1Cc2nc(sc2CNC[C@@H](C)CO)CC1=O
102
{ "fragment_index": 0, "new_substring": "N1&Cc2nc&sc2C1", "old_substring": "N23" }
Can you make molecule C#CCNCC(=O)NC[C@@H](C)CO less soluble in water? The output molecule should be similar to the input molecule.
C#CCN1Cc2cnn(c2CNC[C@@H](C)CO)CC1=O
C#CCNCC(=O)NC[C@@H](C)CO
C#CCN1Cc2cnn(c2CNC[C@@H](C)CO)CC1=O
102
{ "fragment_index": 0, "new_substring": "N1&Cc2cnn&c2C1", "old_substring": "N23" }
Can you make molecule C#CCNCC(=O)NC[C@@H](C)CO less soluble in water? The output molecule should be similar to the input molecule.
C#CCN1CCc2noc(c2CNC[C@@H](C)CO)CC1=O
C#CCNCC(=O)NC[C@@H](C)CO
C#CCN1CCc2noc(c2CNC[C@@H](C)CO)CC1=O
102
{ "fragment_index": 0, "new_substring": "N1&CCc2noc&c2C1", "old_substring": "N23" }
Can you make molecule C#CCNCC(=O)NC[C@@H](C)CO less soluble in water? The output molecule should be similar to the input molecule.
C#CCN1CCCn2nc(cc2NC[C@@H](C)CO)CC1=O
C#CCNCC(=O)NC[C@@H](C)CO
C#CCN1CCCn2nc(cc2NC[C@@H](C)CO)CC1=O
102
{ "fragment_index": 0, "new_substring": "N1&CCCn2nc&cc21", "old_substring": "N23" }
Can you make molecule C#CCNCC(=O)NC[C@@H](C)CO less soluble in water? The output molecule should be similar to the input molecule.
C#CCN1CCc2cc(ccc2NC[C@@H](C)CO)CC1=O
C#CCNCC(=O)NC[C@@H](C)CO
C#CCN1CCc2cc(ccc2NC[C@@H](C)CO)CC1=O
102
{ "fragment_index": 0, "new_substring": "N1&CCc2cc&ccc21", "old_substring": "N23" }
Can you make molecule C#CCCCOC(=O)c1ccc2c(c1)NC(=O)CCN2C less soluble in water? The output molecule should be similar to the input molecule.
C#CCCCOSC(=O)Cc1ccc2c(c1)NC(=O)CCN2C
C#CCCCOC(=O)c1ccc2c(c1)NC(=O)CCN2C
C#CCCCOSC(=O)Cc1ccc2c(c1)NC(=O)CCN2C
102
{ "fragment_index": 0, "new_substring": "S&C(=O)C&", "old_substring": "C35=O" }
Can you make molecule C#CCCCOC(=O)c1ccc2c(c1)NC(=O)CCN2C less soluble in water? The output molecule should be similar to the input molecule.
C#CCCCOC(=O)CCCC(=O)c1ccc2c(c1)NC(=O)CCN2C
C#CCCCOC(=O)c1ccc2c(c1)NC(=O)CCN2C
C#CCCCOC(=O)CCCC(=O)c1ccc2c(c1)NC(=O)CCN2C
102
{ "fragment_index": 0, "new_substring": "C&(=O)CCCC&=O", "old_substring": "C35=O" }
Can you make molecule C#CCCCOC(=O)c1ccc2c(c1)NC(=O)CCN2C less soluble in water? The output molecule should be similar to the input molecule.
C#CCCCOC(=O)CC(C)(C)c1ccc2c(c1)NC(=O)CCN2C
C#CCCCOC(=O)c1ccc2c(c1)NC(=O)CCN2C
C#CCCCOC(=O)CC(C)(C)c1ccc2c(c1)NC(=O)CCN2C
102
{ "fragment_index": 0, "new_substring": "C&(=O)CC&(C)C", "old_substring": "C35=O" }
Can you make molecule C#CCCCOC(=O)c1ccc2c(c1)NC(=O)CCN2C less soluble in water? The output molecule should be similar to the input molecule.
C#CCCCOC(=O)CCC(C)(C)c1ccc2c(c1)NC(=O)CCN2C
C#CCCCOC(=O)c1ccc2c(c1)NC(=O)CCN2C
C#CCCCOC(=O)CCC(C)(C)c1ccc2c(c1)NC(=O)CCN2C
102
{ "fragment_index": 0, "new_substring": "C&(=O)CCC&(C)C", "old_substring": "C35=O" }
Can you make molecule C#CCCCOC(=O)c1ccc2c(c1)NC(=O)CCN2C less soluble in water? The output molecule should be similar to the input molecule.
C#CCCCOSC(=O)[C@@H](C)c1ccc2c(c1)NC(=O)CCN2C
C#CCCCOC(=O)c1ccc2c(c1)NC(=O)CCN2C
C#CCCCOSC(=O)[C@@H](C)c1ccc2c(c1)NC(=O)CCN2C
102
{ "fragment_index": 0, "new_substring": "S&C(=O)[C@H]&C", "old_substring": "C35=O" }
Can you make molecule [NH3+][C@H]1CCC[C@@H]1CCSc1n[nH]c(=O)n1C1CC1 less soluble in water? The output molecule should be similar to the input molecule.
[NH3+][C@H]1CCC[C@@H]1CCSc1n[nH]c(=O)n1C1SCCS1
[NH3+][C@H]1CCC[C@@H]1CCSc1n[nH]c(=O)n1C1CC1
[NH3+][C@H]1CCC[C@@H]1CCSc1n[nH]c(=O)n1C1SCCS1
102
{ "fragment_index": 0, "new_substring": "C1&SCCS1", "old_substring": "C14CC1" }
Can you make molecule [NH3+][C@H]1CCC[C@@H]1CCSc1n[nH]c(=O)n1C1CC1 less soluble in water? The output molecule should be similar to the input molecule.
[NH3+][C@H]1CCC[C@@H]1CCSc1n[nH]c(=O)n1C1CCCCC1
[NH3+][C@H]1CCC[C@@H]1CCSc1n[nH]c(=O)n1C1CC1
[NH3+][C@H]1CCC[C@@H]1CCSc1n[nH]c(=O)n1C1CCCCC1
102
{ "fragment_index": 0, "new_substring": "C1&CCCCC1", "old_substring": "C14CC1" }
Can you make molecule [NH3+][C@H]1CCC[C@@H]1CCSc1n[nH]c(=O)n1C1CC1 less soluble in water? The output molecule should be similar to the input molecule.
[NH3+][C@H]1CCC[C@@H]1CCSc1n[nH]c(=O)n1C1SCCCS1
[NH3+][C@H]1CCC[C@@H]1CCSc1n[nH]c(=O)n1C1CC1
[NH3+][C@H]1CCC[C@@H]1CCSc1n[nH]c(=O)n1C1SCCCS1
102
{ "fragment_index": 0, "new_substring": "C1&SCCCS1", "old_substring": "C14CC1" }
Can you make molecule [NH3+][C@H]1CCC[C@@H]1CCSc1n[nH]c(=O)n1C1CC1 less soluble in water? The output molecule should be similar to the input molecule.
[NH3+][C@H]1CCC[C@@H]1CCSc1n[nH]c(=O)n1C1SCSCS1
[NH3+][C@H]1CCC[C@@H]1CCSc1n[nH]c(=O)n1C1CC1
[NH3+][C@H]1CCC[C@@H]1CCSc1n[nH]c(=O)n1C1SCSCS1
102
{ "fragment_index": 0, "new_substring": "C1&SCSCS1", "old_substring": "C14CC1" }
Can you make molecule [NH3+][C@H]1CCC[C@@H]1CCSc1n[nH]c(=O)n1C1CC1 less soluble in water? The output molecule should be similar to the input molecule.
[NH3+][C@H]1CCC[C@@H]1CCSc1n[nH]c(=O)n1C1CCCCCC1
[NH3+][C@H]1CCC[C@@H]1CCSc1n[nH]c(=O)n1C1CC1
[NH3+][C@H]1CCC[C@@H]1CCSc1n[nH]c(=O)n1C1CCCCCC1
102
{ "fragment_index": 0, "new_substring": "C1&CCCCCC1", "old_substring": "C14CC1" }
Can you make molecule CCNC(=O)Nc1cc(-c2ccccc2C)nn1C less soluble in water? The output molecule should be similar to the input molecule.
CC(C)=NC(=O)Nc1cc(-c2ccccc2C)nn1C
CCNC(=O)Nc1cc(-c2ccccc2C)nn1C
CC(C)=NC(=O)Nc1cc(-c2ccccc2C)nn1C
102
{ "fragment_index": 0, "new_substring": "CC=&C", "old_substring": "CC5" }
Can you make molecule CCNC(=O)Nc1cc(-c2ccccc2C)nn1C less soluble in water? The output molecule should be similar to the input molecule.
C=CSNC(=O)Nc1cc(-c2ccccc2C)nn1C
CCNC(=O)Nc1cc(-c2ccccc2C)nn1C
C=CSNC(=O)Nc1cc(-c2ccccc2C)nn1C
102
{ "fragment_index": 0, "new_substring": "C=CS&", "old_substring": "CC5" }
Can you make molecule CCNC(=O)Nc1cc(-c2ccccc2C)nn1C less soluble in water? The output molecule should be similar to the input molecule.
CC(I)=NC(=O)Nc1cc(-c2ccccc2C)nn1C
CCNC(=O)Nc1cc(-c2ccccc2C)nn1C
CC(I)=NC(=O)Nc1cc(-c2ccccc2C)nn1C
102
{ "fragment_index": 0, "new_substring": "CC=&I", "old_substring": "CC5" }
Can you make molecule CCNC(=O)Nc1cc(-c2ccccc2C)nn1C less soluble in water? The output molecule should be similar to the input molecule.
C=CCCNC(=O)Nc1cc(-c2ccccc2C)nn1C
CCNC(=O)Nc1cc(-c2ccccc2C)nn1C
C=CCCNC(=O)Nc1cc(-c2ccccc2C)nn1C
102
{ "fragment_index": 0, "new_substring": "C=CCC&", "old_substring": "CC5" }
Can you make molecule CCNC(=O)Nc1cc(-c2ccccc2C)nn1C less soluble in water? The output molecule should be similar to the input molecule.
Cc1ccccc1-c1cc(NC(=O)N=CCCl)n(C)n1
CCNC(=O)Nc1cc(-c2ccccc2C)nn1C
Cc1ccccc1-c1cc(NC(=O)N=CCCl)n(C)n1
102
{ "fragment_index": 0, "new_substring": "C=&CCl", "old_substring": "CC5" }
Can you make molecule c1ccc(-c2ccc(NCc3ccc4c(c3)OCO4)nn2)cc1 less soluble in water? The output molecule should be similar to the input molecule.
CN(Cc1ccc2c(c1)OCO2)C(=S)Sc1ccc(-c2ccccc2)nn1
c1ccc(-c2ccc(NCc3ccc4c(c3)OCO4)nn2)cc1
CN(Cc1ccc2c(c1)OCO2)C(=S)Sc1ccc(-c2ccccc2)nn1
102
{ "fragment_index": 0, "new_substring": "CN&C(=S)S&", "old_substring": "N56" }
Can you make molecule c1ccc(-c2ccc(NCc3ccc4c(c3)OCO4)nn2)cc1 less soluble in water? The output molecule should be similar to the input molecule.
c1ccc(-c2ccc(SC3=NCCN3Cc3ccc4c(c3)OCO4)nn2)cc1
c1ccc(-c2ccc(NCc3ccc4c(c3)OCO4)nn2)cc1
c1ccc(-c2ccc(SC3=NCCN3Cc3ccc4c(c3)OCO4)nn2)cc1
102
{ "fragment_index": 0, "new_substring": "N1&CCN=C1S&", "old_substring": "N56" }
Can you make molecule c1ccc(-c2ccc(NCc3ccc4c(c3)OCO4)nn2)cc1 less soluble in water? The output molecule should be similar to the input molecule.
c1ccc(-c2ccc(C3CCN(CCc4ccc5c(c4)OCO5)CC3)nn2)cc1
c1ccc(-c2ccc(NCc3ccc4c(c3)OCO4)nn2)cc1
c1ccc(-c2ccc(C3CCN(CCc4ccc5c(c4)OCO5)CC3)nn2)cc1
102
{ "fragment_index": 0, "new_substring": "C&N1CCC&CC1", "old_substring": "N56" }
Can you make molecule c1ccc(-c2ccc(NCc3ccc4c(c3)OCO4)nn2)cc1 less soluble in water? The output molecule should be similar to the input molecule.
Nc1c(Cc2ccc3c(c2)OCO3)cccc1-c1ccc(-c2ccccc2)nn1
c1ccc(-c2ccc(NCc3ccc4c(c3)OCO4)nn2)cc1
Nc1c(Cc2ccc3c(c2)OCO3)cccc1-c1ccc(-c2ccccc2)nn1
102
{ "fragment_index": 0, "new_substring": "Nc1c&cccc1&", "old_substring": "N56" }
Can you make molecule c1ccc(-c2ccc(NCc3ccc4c(c3)OCO4)nn2)cc1 less soluble in water? The output molecule should be similar to the input molecule.
Nc1cc(Cc2ccc3c(c2)OCO3)cc(-c2ccc(-c3ccccc3)nn2)c1
c1ccc(-c2ccc(NCc3ccc4c(c3)OCO4)nn2)cc1
Nc1cc(Cc2ccc3c(c2)OCO3)cc(-c2ccc(-c3ccccc3)nn2)c1
102
{ "fragment_index": 0, "new_substring": "Nc1cc&cc&c1", "old_substring": "N56" }
Can you make molecule O[C@@H](C1CCCCCC1)[C@H]1CCO[C@]2(CCOC2)C1 less soluble in water? The output molecule should be similar to the input molecule.
O[C@@H](SC1=CCCCCC1)[C@H]1CCO[C@]2(CCOC2)C1
O[C@@H](C1CCCCCC1)[C@H]1CCO[C@]2(CCOC2)C1
O[C@@H](SC1=CCCCCC1)[C@H]1CCO[C@]2(CCOC2)C1
102
{ "fragment_index": 0, "new_substring": "C1=C(S&)CCCCC1", "old_substring": "C13CCCCCC1" }
Can you make molecule O[C@@H](C1CCCCCC1)[C@H]1CCO[C@]2(CCOC2)C1 less soluble in water? The output molecule should be similar to the input molecule.
O[C@@H](C1CCCCCCCCCCC1)[C@H]1CCO[C@]2(CCOC2)C1
O[C@@H](C1CCCCCC1)[C@H]1CCO[C@]2(CCOC2)C1
O[C@@H](C1CCCCCCCCCCC1)[C@H]1CCO[C@]2(CCOC2)C1
102
{ "fragment_index": 0, "new_substring": "C1&CCCCCCCCCCC1", "old_substring": "C13CCCCCC1" }
Can you make molecule O[C@@H](C1CCCCCC1)[C@H]1CCO[C@]2(CCOC2)C1 less soluble in water? The output molecule should be similar to the input molecule.
O[C@@H](C1C2=CC=CC=C1CCCC2)[C@H]1CCO[C@]2(CCOC2)C1
O[C@@H](C1CCCCCC1)[C@H]1CCO[C@]2(CCOC2)C1
O[C@@H](C1C2=CC=CC=C1CCCC2)[C@H]1CCO[C@]2(CCOC2)C1
102
{ "fragment_index": 0, "new_substring": "C1&C2=CC=CC=C1CCCC2", "old_substring": "C13CCCCCC1" }
Can you make molecule O[C@@H](C1CCCCCC1)[C@H]1CCO[C@]2(CCOC2)C1 less soluble in water? The output molecule should be similar to the input molecule.
CCCCCC[C@@H](C)[C@H](O)[C@H]1CCO[C@]2(CCOC2)C1
O[C@@H](C1CCCCCC1)[C@H]1CCO[C@]2(CCOC2)C1
CCCCCC[C@@H](C)[C@H](O)[C@H]1CCO[C@]2(CCOC2)C1
102
{ "fragment_index": 0, "new_substring": "CCCCCC[C@H]&C", "old_substring": "C13CCCCCC1" }
Can you make molecule O[C@@H](C1CCCCCC1)[C@H]1CCO[C@]2(CCOC2)C1 less soluble in water? The output molecule should be similar to the input molecule.
CCC(CC)(CC)C[C@H](O)[C@H]1CCO[C@]2(CCOC2)C1
O[C@@H](C1CCCCCC1)[C@H]1CCO[C@]2(CCOC2)C1
CCC(CC)(CC)C[C@H](O)[C@H]1CCO[C@]2(CCOC2)C1
102
{ "fragment_index": 0, "new_substring": "CCC(C&)(CC)CC", "old_substring": "C13CCCCCC1" }
Can you make molecule Cc1c(Cl)ccc2c1NC(=O)[C@@]21[C@@H]2C(=O)N(c3ccc(F)cc3)C(=O)[C@@H]2[C@@H]2CCC[NH+]21 less soluble in water? The output molecule should be similar to the input molecule.
Cc1c(Cl)ccc2c1NC(=O)[C@@]21[C@@H]2C(=O)N(c3ccc(F)cc3Cl)C(=O)[C@@H]2[C@@H]2CCC[NH+]21
Cc1c(Cl)ccc2c1NC(=O)[C@@]21[C@@H]2C(=O)N(c3ccc(F)cc3)C(=O)[C@@H]2[C@@H]2CCC[NH+]21
Cc1c(Cl)ccc2c1NC(=O)[C@@]21[C@@H]2C(=O)N(c3ccc(F)cc3Cl)C(=O)[C@@H]2[C@@H]2CCC[NH+]21
102
{ "fragment_index": 0, "new_substring": "c1&ccc(F)cc1Cl", "old_substring": "c14ccc(F)cc1" }
Can you make molecule Cc1c(Cl)ccc2c1NC(=O)[C@@]21[C@@H]2C(=O)N(c3ccc(F)cc3)C(=O)[C@@H]2[C@@H]2CCC[NH+]21 less soluble in water? The output molecule should be similar to the input molecule.
Cc1c(Cl)ccc2c1NC(=O)[C@@]21[C@@H]2C(=O)N(c3ccc(F)cc3Br)C(=O)[C@@H]2[C@@H]2CCC[NH+]21
Cc1c(Cl)ccc2c1NC(=O)[C@@]21[C@@H]2C(=O)N(c3ccc(F)cc3)C(=O)[C@@H]2[C@@H]2CCC[NH+]21
Cc1c(Cl)ccc2c1NC(=O)[C@@]21[C@@H]2C(=O)N(c3ccc(F)cc3Br)C(=O)[C@@H]2[C@@H]2CCC[NH+]21
102
{ "fragment_index": 0, "new_substring": "c1&ccc(F)cc1Br", "old_substring": "c14ccc(F)cc1" }
Can you make molecule Cc1c(Cl)ccc2c1NC(=O)[C@@]21[C@@H]2C(=O)N(c3ccc(F)cc3)C(=O)[C@@H]2[C@@H]2CCC[NH+]21 less soluble in water? The output molecule should be similar to the input molecule.
Cc1c(Cl)ccc2c1NC(=O)[C@@]21[C@@H]2C(=O)N(c3ccc(F)c(Cl)c3)C(=O)[C@@H]2[C@@H]2CCC[NH+]21
Cc1c(Cl)ccc2c1NC(=O)[C@@]21[C@@H]2C(=O)N(c3ccc(F)cc3)C(=O)[C@@H]2[C@@H]2CCC[NH+]21
Cc1c(Cl)ccc2c1NC(=O)[C@@]21[C@@H]2C(=O)N(c3ccc(F)c(Cl)c3)C(=O)[C@@H]2[C@@H]2CCC[NH+]21
102
{ "fragment_index": 0, "new_substring": "c1&ccc(F)c(Cl)c1", "old_substring": "c14ccc(F)cc1" }
Can you make molecule Cc1c(Cl)ccc2c1NC(=O)[C@@]21[C@@H]2C(=O)N(c3ccc(F)cc3)C(=O)[C@@H]2[C@@H]2CCC[NH+]21 less soluble in water? The output molecule should be similar to the input molecule.
Cc1c(Cl)ccc2c1NC(=O)[C@@]21[C@@H]2C(=O)N(c3ccc(I)cc3F)C(=O)[C@@H]2[C@@H]2CCC[NH+]21
Cc1c(Cl)ccc2c1NC(=O)[C@@]21[C@@H]2C(=O)N(c3ccc(F)cc3)C(=O)[C@@H]2[C@@H]2CCC[NH+]21
Cc1c(Cl)ccc2c1NC(=O)[C@@]21[C@@H]2C(=O)N(c3ccc(I)cc3F)C(=O)[C@@H]2[C@@H]2CCC[NH+]21
102
{ "fragment_index": 0, "new_substring": "c1&ccc(I)cc1F", "old_substring": "c14ccc(F)cc1" }
Can you make molecule Cc1c(Cl)ccc2c1NC(=O)[C@@]21[C@@H]2C(=O)N(c3ccc(F)cc3)C(=O)[C@@H]2[C@@H]2CCC[NH+]21 less soluble in water? The output molecule should be similar to the input molecule.
Cc1c(Cl)ccc2c1NC(=O)[C@@]21[C@@H]2C(=O)N(c3cc4c(F)cccc4s3)C(=O)[C@@H]2[C@@H]2CCC[NH+]21
Cc1c(Cl)ccc2c1NC(=O)[C@@]21[C@@H]2C(=O)N(c3ccc(F)cc3)C(=O)[C@@H]2[C@@H]2CCC[NH+]21
Cc1c(Cl)ccc2c1NC(=O)[C@@]21[C@@H]2C(=O)N(c3cc4c(F)cccc4s3)C(=O)[C@@H]2[C@@H]2CCC[NH+]21
102
{ "fragment_index": 0, "new_substring": "c1&cc2c(F)cccc2s1", "old_substring": "c14ccc(F)cc1" }
Can you make molecule CC[NH2+][C@H](Cc1ncnn1CC)[C@@H]1CN(C)CCO1 less soluble in water? The output molecule should be similar to the input molecule.
CCn1ncnc1C[C@@H]([NH2+]C1=CC=CC=C2CC2(C)C1)[C@@H]1CN(C)CCO1
CC[NH2+][C@H](Cc1ncnn1CC)[C@@H]1CN(C)CCO1
CCn1ncnc1C[C@@H]([NH2+]C1=CC=CC=C2CC2(C)C1)[C@@H]1CN(C)CCO1
102
{ "fragment_index": 0, "new_substring": "CC1&Cc2ccccc2C1", "old_substring": "CC2" }
Can you make molecule CC[NH2+][C@H](Cc1ncnn1CC)[C@@H]1CN(C)CCO1 less soluble in water? The output molecule should be similar to the input molecule.
CCn1ncnc1C[C@@H]([NH2+]C1=NC2=C(CCCC1(C)C)S2)[C@@H]1CN(C)CCO1
CC[NH2+][C@H](Cc1ncnn1CC)[C@@H]1CN(C)CCO1
CCn1ncnc1C[C@@H]([NH2+]C1=NC2=C(CCCC1(C)C)S2)[C@@H]1CN(C)CCO1
102
{ "fragment_index": 0, "new_substring": "CC1(C)CCCc2sc&nc21", "old_substring": "CC2" }
Can you make molecule CC[NH2+][C@H](Cc1ncnn1CC)[C@@H]1CN(C)CCO1 less soluble in water? The output molecule should be similar to the input molecule.
CCn1ncnc1C[C@@H]([NH2+]C1=CC=C2C=C2CC(C)(C)O1)[C@@H]1CN(C)CCO1
CC[NH2+][C@H](Cc1ncnn1CC)[C@@H]1CN(C)CCO1
CCn1ncnc1C[C@@H]([NH2+]C1=CC=C2C=C2CC(C)(C)O1)[C@@H]1CN(C)CCO1
102
{ "fragment_index": 0, "new_substring": "CC1(C)Cc2cc&ccc2O1", "old_substring": "CC2" }
Can you make molecule CC[NH2+][C@H](Cc1ncnn1CC)[C@@H]1CN(C)CCO1 less soluble in water? The output molecule should be similar to the input molecule.
CCn1ncnc1C[C@@H]([NH2+]C1=CC=C2C=C2CCN1C)[C@@H]1CN(C)CCO1
CC[NH2+][C@H](Cc1ncnn1CC)[C@@H]1CN(C)CCO1
CCn1ncnc1C[C@@H]([NH2+]C1=CC=C2C=C2CCN1C)[C@@H]1CN(C)CCO1
102
{ "fragment_index": 0, "new_substring": "CN1CCc2cc&ccc21", "old_substring": "CC2" }
Can you make molecule CC[NH2+][C@H](Cc1ncnn1CC)[C@@H]1CN(C)CCO1 less soluble in water? The output molecule should be similar to the input molecule.
CCn1ncnc1C[C@@H]([NH2+]CCCCC12CC1C2)[C@@H]1CN(C)CCO1
CC[NH2+][C@H](Cc1ncnn1CC)[C@@H]1CN(C)CCO1
CCn1ncnc1C[C@@H]([NH2+]CCCCC12CC1C2)[C@@H]1CN(C)CCO1
102
{ "fragment_index": 0, "new_substring": "C1&CC2(CCCC2)C1", "old_substring": "CC2" }
Can you make molecule CC(=O)NCCOc1ccc(C)c(C)c1 less soluble in water? The output molecule should be similar to the input molecule.
CC(=O)N1Cc2nc(CCOc3ccc(C)c(C)c3)sc2C1
CC(=O)NCCOc1ccc(C)c(C)c1
CC(=O)N1Cc2nc(CCOc3ccc(C)c(C)c3)sc2C1
102
{ "fragment_index": 0, "new_substring": "N1&Cc2nc&sc2C1", "old_substring": "N25" }
Can you make molecule CC(=O)NCCOc1ccc(C)c(C)c1 less soluble in water? The output molecule should be similar to the input molecule.
CC(=O)N1Cc2cnn(CCOc3ccc(C)c(C)c3)c2C1
CC(=O)NCCOc1ccc(C)c(C)c1
CC(=O)N1Cc2cnn(CCOc3ccc(C)c(C)c3)c2C1
102
{ "fragment_index": 0, "new_substring": "N1&Cc2cnn&c2C1", "old_substring": "N25" }
Can you make molecule CC(=O)NCCOc1ccc(C)c(C)c1 less soluble in water? The output molecule should be similar to the input molecule.
CC(=O)N1CCc2noc(CCOc3ccc(C)c(C)c3)c2C1
CC(=O)NCCOc1ccc(C)c(C)c1
CC(=O)N1CCc2noc(CCOc3ccc(C)c(C)c3)c2C1
102
{ "fragment_index": 0, "new_substring": "N1&CCc2noc&c2C1", "old_substring": "N25" }
Can you make molecule CC(=O)NCCOc1ccc(C)c(C)c1 less soluble in water? The output molecule should be similar to the input molecule.
CC(=O)N1CCCn2nc(CCOc3ccc(C)c(C)c3)cc21
CC(=O)NCCOc1ccc(C)c(C)c1
CC(=O)N1CCCn2nc(CCOc3ccc(C)c(C)c3)cc21
102
{ "fragment_index": 0, "new_substring": "N1&CCCn2nc&cc21", "old_substring": "N25" }
Can you make molecule CC(=O)NCCOc1ccc(C)c(C)c1 less soluble in water? The output molecule should be similar to the input molecule.
CC(=O)N1CCc2cc(CCOc3ccc(C)c(C)c3)ccc21
CC(=O)NCCOc1ccc(C)c(C)c1
CC(=O)N1CCc2cc(CCOc3ccc(C)c(C)c3)ccc21
102
{ "fragment_index": 0, "new_substring": "N1&CCc2cc&ccc21", "old_substring": "N25" }
Can you make molecule CN[C@]1(C#N)CCC[C@@H](Oc2cc(F)ccc2[N+](=O)[O-])C1 less soluble in water? The output molecule should be similar to the input molecule.
CN(C)C[C@]1(C#N)CCC[C@@H](Oc2cc(F)ccc2[N+](=O)[O-])C1
CN[C@]1(C#N)CCC[C@@H](Oc2cc(F)ccc2[N+](=O)[O-])C1
CN(C)C[C@]1(C#N)CCC[C@@H](Oc2cc(F)ccc2[N+](=O)[O-])C1
102
{ "fragment_index": 0, "new_substring": "CN(C)C&", "old_substring": "CN5" }
Can you make molecule CN[C@]1(C#N)CCC[C@@H](Oc2cc(F)ccc2[N+](=O)[O-])C1 less soluble in water? The output molecule should be similar to the input molecule.
N#C[C@@]1(CN=C=S)CCC[C@@H](Oc2cc(F)ccc2[N+](=O)[O-])C1
CN[C@]1(C#N)CCC[C@@H](Oc2cc(F)ccc2[N+](=O)[O-])C1
N#C[C@@]1(CN=C=S)CCC[C@@H](Oc2cc(F)ccc2[N+](=O)[O-])C1
102
{ "fragment_index": 0, "new_substring": "C&N=C=S", "old_substring": "CN5" }
Can you make molecule CN[C@]1(C#N)CCC[C@@H](Oc2cc(F)ccc2[N+](=O)[O-])C1 less soluble in water? The output molecule should be similar to the input molecule.
N#C[C@@]1(C2N=N2)CCC[C@@H](Oc2cc(F)ccc2[N+](=O)[O-])C1
CN[C@]1(C#N)CCC[C@@H](Oc2cc(F)ccc2[N+](=O)[O-])C1
N#C[C@@]1(C2N=N2)CCC[C@@H](Oc2cc(F)ccc2[N+](=O)[O-])C1
102
{ "fragment_index": 0, "new_substring": "C1&N=N1", "old_substring": "CN5" }
Can you make molecule CN[C@]1(C#N)CCC[C@@H](Oc2cc(F)ccc2[N+](=O)[O-])C1 less soluble in water? The output molecule should be similar to the input molecule.
C/C=N/O[C@]1(C#N)CCC[C@@H](Oc2cc(F)ccc2[N+](=O)[O-])C1
CN[C@]1(C#N)CCC[C@@H](Oc2cc(F)ccc2[N+](=O)[O-])C1
C/C=N/O[C@]1(C#N)CCC[C@@H](Oc2cc(F)ccc2[N+](=O)[O-])C1
102
{ "fragment_index": 0, "new_substring": "C/C=N/O&", "old_substring": "CN5" }
Can you make molecule CN[C@]1(C#N)CCC[C@@H](Oc2cc(F)ccc2[N+](=O)[O-])C1 less soluble in water? The output molecule should be similar to the input molecule.
N#C[C@@]1(CC(N)=S)CCC[C@@H](Oc2cc(F)ccc2[N+](=O)[O-])C1
CN[C@]1(C#N)CCC[C@@H](Oc2cc(F)ccc2[N+](=O)[O-])C1
N#C[C@@]1(CC(N)=S)CCC[C@@H](Oc2cc(F)ccc2[N+](=O)[O-])C1
102
{ "fragment_index": 0, "new_substring": "C&C(N)=S", "old_substring": "CN5" }
Can you make molecule CC[C@H](NC(=O)N1CC[C@H](C)[C@@H]1C)c1cccc([N+](=O)[O-])c1 less soluble in water? The output molecule should be similar to the input molecule.
CC[C@H](NC(=O)CC(C)(C)N1CC[C@H](C)[C@@H]1C)c1cccc([N+](=O)[O-])c1
CC[C@H](NC(=O)N1CC[C@H](C)[C@@H]1C)c1cccc([N+](=O)[O-])c1
CC[C@H](NC(=O)CC(C)(C)N1CC[C@H](C)[C@@H]1C)c1cccc([N+](=O)[O-])c1
102
{ "fragment_index": 0, "new_substring": "C&(=O)CC&(C)C", "old_substring": "C23=O" }
Can you make molecule CC[C@H](NC(=O)N1CC[C@H](C)[C@@H]1C)c1cccc([N+](=O)[O-])c1 less soluble in water? The output molecule should be similar to the input molecule.
CC[C@H](NC(=O)CCC(C)(C)N1CC[C@H](C)[C@@H]1C)c1cccc([N+](=O)[O-])c1
CC[C@H](NC(=O)N1CC[C@H](C)[C@@H]1C)c1cccc([N+](=O)[O-])c1
CC[C@H](NC(=O)CCC(C)(C)N1CC[C@H](C)[C@@H]1C)c1cccc([N+](=O)[O-])c1
102
{ "fragment_index": 0, "new_substring": "C&(=O)CCC&(C)C", "old_substring": "C23=O" }
Can you make molecule CC[C@H](NC(=O)N1CC[C@H](C)[C@@H]1C)c1cccc([N+](=O)[O-])c1 less soluble in water? The output molecule should be similar to the input molecule.
CC[C@H](NC(=O)C[C@@H](Br)N1CC[C@H](C)[C@@H]1C)c1cccc([N+](=O)[O-])c1
CC[C@H](NC(=O)N1CC[C@H](C)[C@@H]1C)c1cccc([N+](=O)[O-])c1
CC[C@H](NC(=O)C[C@@H](Br)N1CC[C@H](C)[C@@H]1C)c1cccc([N+](=O)[O-])c1
102
{ "fragment_index": 0, "new_substring": "C&(=O)C[C@H]&Br", "old_substring": "C23=O" }
Can you make molecule CC[C@H](NC(=O)N1CC[C@H](C)[C@@H]1C)c1cccc([N+](=O)[O-])c1 less soluble in water? The output molecule should be similar to the input molecule.
CC[C@H](Nc1cc(C)n(N2CC[C@H](C)[C@@H]2C)c(=O)c1)c1cccc([N+](=O)[O-])c1
CC[C@H](NC(=O)N1CC[C@H](C)[C@@H]1C)c1cccc([N+](=O)[O-])c1
CC[C@H](Nc1cc(C)n(N2CC[C@H](C)[C@@H]2C)c(=O)c1)c1cccc([N+](=O)[O-])c1
102
{ "fragment_index": 0, "new_substring": "Cc1cc&cc(=O)n1&", "old_substring": "C23=O" }
Can you make molecule CC[C@H](NC(=O)N1CC[C@H](C)[C@@H]1C)c1cccc([N+](=O)[O-])c1 less soluble in water? The output molecule should be similar to the input molecule.
CC[C@H](Nc1c(C)n(N2CC[C@H](C)[C@@H]2C)ccc1=O)c1cccc([N+](=O)[O-])c1
CC[C@H](NC(=O)N1CC[C@H](C)[C@@H]1C)c1cccc([N+](=O)[O-])c1
CC[C@H](Nc1c(C)n(N2CC[C@H](C)[C@@H]2C)ccc1=O)c1cccc([N+](=O)[O-])c1
102
{ "fragment_index": 0, "new_substring": "Cc1c&c(=O)ccn1&", "old_substring": "C23=O" }
Can you make molecule CN(CC[C@@H]1CCC[C@]1(N)C#N)CC[NH+]1CCCC1 less soluble in water? The output molecule should be similar to the input molecule.
CN(CCCC[C@@H]1CCC[C@]1(N)C#N)CC[NH+]1CCCC1
CN(CC[C@@H]1CCC[C@]1(N)C#N)CC[NH+]1CCCC1
CN(CCCC[C@@H]1CCC[C@]1(N)C#N)CC[NH+]1CCCC1
102
{ "fragment_index": 0, "new_substring": "C&CCC&", "old_substring": "C2C5" }
Can you make molecule CN(CC[C@@H]1CCC[C@]1(N)C#N)CC[NH+]1CCCC1 less soluble in water? The output molecule should be similar to the input molecule.
CN(CCCCC[C@@H]1CCC[C@]1(N)C#N)CC[NH+]1CCCC1
CN(CC[C@@H]1CCC[C@]1(N)C#N)CC[NH+]1CCCC1
CN(CCCCC[C@@H]1CCC[C@]1(N)C#N)CC[NH+]1CCCC1
102
{ "fragment_index": 0, "new_substring": "C&CCCC&", "old_substring": "C2C5" }
Can you make molecule CN(CC[C@@H]1CCC[C@]1(N)C#N)CC[NH+]1CCCC1 less soluble in water? The output molecule should be similar to the input molecule.
C[C@@H](CC[C@@H]1CCC[C@]1(N)C#N)N(C)CC[NH+]1CCCC1
CN(CC[C@@H]1CCC[C@]1(N)C#N)CC[NH+]1CCCC1
C[C@@H](CC[C@@H]1CCC[C@]1(N)C#N)N(C)CC[NH+]1CCCC1
102
{ "fragment_index": 0, "new_substring": "C[C@H]&CC&", "old_substring": "C2C5" }
Can you make molecule CN(CC[C@@H]1CCC[C@]1(N)C#N)CC[NH+]1CCCC1 less soluble in water? The output molecule should be similar to the input molecule.
CN(CC[NH+]1CCCC1)C1CCC([C@@H]2CCC[C@]2(N)C#N)CC1
CN(CC[C@@H]1CCC[C@]1(N)C#N)CC[NH+]1CCCC1
CN(CC[NH+]1CCCC1)C1CCC([C@@H]2CCC[C@]2(N)C#N)CC1
102
{ "fragment_index": 0, "new_substring": "C1&CCC&CC1", "old_substring": "C2C5" }
Can you make molecule CN(CC[C@@H]1CCC[C@]1(N)C#N)CC[NH+]1CCCC1 less soluble in water? The output molecule should be similar to the input molecule.
CN(CC[NH+]1CCCC1)CC(C)(C)C[C@@H]1CCC[C@]1(N)C#N
CN(CC[C@@H]1CCC[C@]1(N)C#N)CC[NH+]1CCCC1
CN(CC[NH+]1CCCC1)CC(C)(C)C[C@@H]1CCC[C@]1(N)C#N
102
{ "fragment_index": 0, "new_substring": "CC(C)(C&)C&", "old_substring": "C2C5" }
Can you make molecule Cc1c(Cl)cccc1NC(=O)c1c(F)cccc1Cl less soluble in water? The output molecule should be similar to the input molecule.
Cc1c(Cl)cccc1NSC(=O)Cc1c(F)cccc1Cl
Cc1c(Cl)cccc1NC(=O)c1c(F)cccc1Cl
Cc1c(Cl)cccc1NSC(=O)Cc1c(F)cccc1Cl
102
{ "fragment_index": 0, "new_substring": "S&C(=O)C&", "old_substring": "C24=O" }
Can you make molecule Cc1c(Cl)cccc1NC(=O)c1c(F)cccc1Cl less soluble in water? The output molecule should be similar to the input molecule.
Cc1c(Cl)cccc1NC(=O)CCCC(=O)c1c(F)cccc1Cl
Cc1c(Cl)cccc1NC(=O)c1c(F)cccc1Cl
Cc1c(Cl)cccc1NC(=O)CCCC(=O)c1c(F)cccc1Cl
102
{ "fragment_index": 0, "new_substring": "C&(=O)CCCC&=O", "old_substring": "C24=O" }
Can you make molecule Cc1c(Cl)cccc1NC(=O)c1c(F)cccc1Cl less soluble in water? The output molecule should be similar to the input molecule.
Cc1c(Cl)cccc1NC(=O)CC(C)(C)c1c(F)cccc1Cl
Cc1c(Cl)cccc1NC(=O)c1c(F)cccc1Cl
Cc1c(Cl)cccc1NC(=O)CC(C)(C)c1c(F)cccc1Cl
102
{ "fragment_index": 0, "new_substring": "C&(=O)CC&(C)C", "old_substring": "C24=O" }
Can you make molecule Cc1c(Cl)cccc1NC(=O)c1c(F)cccc1Cl less soluble in water? The output molecule should be similar to the input molecule.
Cc1c(Cl)cccc1NC(=O)CCC(C)(C)c1c(F)cccc1Cl
Cc1c(Cl)cccc1NC(=O)c1c(F)cccc1Cl
Cc1c(Cl)cccc1NC(=O)CCC(C)(C)c1c(F)cccc1Cl
102
{ "fragment_index": 0, "new_substring": "C&(=O)CCC&(C)C", "old_substring": "C24=O" }
Can you make molecule Cc1c(Cl)cccc1NC(=O)c1c(F)cccc1Cl less soluble in water? The output molecule should be similar to the input molecule.
Cc1c(Cl)cccc1NSC(=O)[C@@H](C)c1c(F)cccc1Cl
Cc1c(Cl)cccc1NC(=O)c1c(F)cccc1Cl
Cc1c(Cl)cccc1NSC(=O)[C@@H](C)c1c(F)cccc1Cl
102
{ "fragment_index": 0, "new_substring": "S&C(=O)[C@H]&C", "old_substring": "C24=O" }
Can you make molecule O=C(Nc1ccc(N2CCOCC2)cc1)c1cccc(S(=O)(=O)NCc2ccc3c(c2)OCO3)c1 less soluble in water? The output molecule should be similar to the input molecule.
O=C(Nc1ccc(N2CCCC2)cc1)c1cccc(S(=O)(=O)NCc2ccc3c(c2)OCO3)c1
O=C(Nc1ccc(N2CCOCC2)cc1)c1cccc(S(=O)(=O)NCc2ccc3c(c2)OCO3)c1
O=C(Nc1ccc(N2CCCC2)cc1)c1cccc(S(=O)(=O)NCc2ccc3c(c2)OCO3)c1
102
{ "fragment_index": 0, "new_substring": "N1&CCCC1", "old_substring": "N18CCOCC1" }
Can you make molecule O=C(Nc1ccc(N2CCOCC2)cc1)c1cccc(S(=O)(=O)NCc2ccc3c(c2)OCO3)c1 less soluble in water? The output molecule should be similar to the input molecule.
O=C(Nc1ccc(N2CCCCC2)cc1)c1cccc(S(=O)(=O)NCc2ccc3c(c2)OCO3)c1
O=C(Nc1ccc(N2CCOCC2)cc1)c1cccc(S(=O)(=O)NCc2ccc3c(c2)OCO3)c1
O=C(Nc1ccc(N2CCCCC2)cc1)c1cccc(S(=O)(=O)NCc2ccc3c(c2)OCO3)c1
102
{ "fragment_index": 0, "new_substring": "N1&CCCCC1", "old_substring": "N18CCOCC1" }
Can you make molecule O=C(Nc1ccc(N2CCOCC2)cc1)c1cccc(S(=O)(=O)NCc2ccc3c(c2)OCO3)c1 less soluble in water? The output molecule should be similar to the input molecule.
O=C(Nc1ccc(N2CCSCC2)cc1)c1cccc(S(=O)(=O)NCc2ccc3c(c2)OCO3)c1
O=C(Nc1ccc(N2CCOCC2)cc1)c1cccc(S(=O)(=O)NCc2ccc3c(c2)OCO3)c1
O=C(Nc1ccc(N2CCSCC2)cc1)c1cccc(S(=O)(=O)NCc2ccc3c(c2)OCO3)c1
102
{ "fragment_index": 0, "new_substring": "N1&CCSCC1", "old_substring": "N18CCOCC1" }
Can you make molecule O=C(Nc1ccc(N2CCOCC2)cc1)c1cccc(S(=O)(=O)NCc2ccc3c(c2)OCO3)c1 less soluble in water? The output molecule should be similar to the input molecule.
O=C(Nc1ccc(N2CC=CC2)cc1)c1cccc(S(=O)(=O)NCc2ccc3c(c2)OCO3)c1
O=C(Nc1ccc(N2CCOCC2)cc1)c1cccc(S(=O)(=O)NCc2ccc3c(c2)OCO3)c1
O=C(Nc1ccc(N2CC=CC2)cc1)c1cccc(S(=O)(=O)NCc2ccc3c(c2)OCO3)c1
102
{ "fragment_index": 0, "new_substring": "N1&CC=CC1", "old_substring": "N18CCOCC1" }
Can you make molecule O=C(Nc1ccc(N2CCOCC2)cc1)c1cccc(S(=O)(=O)NCc2ccc3c(c2)OCO3)c1 less soluble in water? The output molecule should be similar to the input molecule.
O=C(Nc1ccc(SSN2CCOCC2)cc1)c1cccc(S(=O)(=O)NCc2ccc3c(c2)OCO3)c1
O=C(Nc1ccc(N2CCOCC2)cc1)c1cccc(S(=O)(=O)NCc2ccc3c(c2)OCO3)c1
O=C(Nc1ccc(SSN2CCOCC2)cc1)c1cccc(S(=O)(=O)NCc2ccc3c(c2)OCO3)c1
102
{ "fragment_index": 0, "new_substring": "S&SN1CCOCC1", "old_substring": "N18CCOCC1" }
Can you make molecule C[C@H](OC(=O)c1ccoc1)c1nc2ccccc2n1C less soluble in water? The output molecule should be similar to the input molecule.
C[C@H](OSC(=O)Cc1ccoc1)c1nc2ccccc2n1C
C[C@H](OC(=O)c1ccoc1)c1nc2ccccc2n1C
C[C@H](OSC(=O)Cc1ccoc1)c1nc2ccccc2n1C
102
{ "fragment_index": 0, "new_substring": "S&C(=O)C&", "old_substring": "C35=O" }
Can you make molecule C[C@H](OC(=O)c1ccoc1)c1nc2ccccc2n1C less soluble in water? The output molecule should be similar to the input molecule.
C[C@H](OC(=O)CCCC(=O)c1ccoc1)c1nc2ccccc2n1C
C[C@H](OC(=O)c1ccoc1)c1nc2ccccc2n1C
C[C@H](OC(=O)CCCC(=O)c1ccoc1)c1nc2ccccc2n1C
102
{ "fragment_index": 0, "new_substring": "C&(=O)CCCC&=O", "old_substring": "C35=O" }
Can you make molecule C[C@H](OC(=O)c1ccoc1)c1nc2ccccc2n1C less soluble in water? The output molecule should be similar to the input molecule.
C[C@H](OC(=O)CC(C)(C)c1ccoc1)c1nc2ccccc2n1C
C[C@H](OC(=O)c1ccoc1)c1nc2ccccc2n1C
C[C@H](OC(=O)CC(C)(C)c1ccoc1)c1nc2ccccc2n1C
102
{ "fragment_index": 0, "new_substring": "C&(=O)CC&(C)C", "old_substring": "C35=O" }
Can you make molecule C[C@H](OC(=O)c1ccoc1)c1nc2ccccc2n1C less soluble in water? The output molecule should be similar to the input molecule.
C[C@H](OC(=O)CCC(C)(C)c1ccoc1)c1nc2ccccc2n1C
C[C@H](OC(=O)c1ccoc1)c1nc2ccccc2n1C
C[C@H](OC(=O)CCC(C)(C)c1ccoc1)c1nc2ccccc2n1C
102
{ "fragment_index": 0, "new_substring": "C&(=O)CCC&(C)C", "old_substring": "C35=O" }
Can you make molecule C[C@H](OC(=O)c1ccoc1)c1nc2ccccc2n1C less soluble in water? The output molecule should be similar to the input molecule.
C[C@H](OSC(=O)[C@@H](C)c1ccoc1)c1nc2ccccc2n1C
C[C@H](OC(=O)c1ccoc1)c1nc2ccccc2n1C
C[C@H](OSC(=O)[C@@H](C)c1ccoc1)c1nc2ccccc2n1C
102
{ "fragment_index": 0, "new_substring": "S&C(=O)[C@H]&C", "old_substring": "C35=O" }
Can you make molecule COc1ccc(-c2onc(C(=O)c3ccc([N+](=O)[O-])cc3)c2S(=O)(=O)c2ccccc2)cc1 less soluble in water? The output molecule should be similar to the input molecule.
COc1ccc(-c2onc(SC(=O)Cc3ccc([N+](=O)[O-])cc3)c2S(=O)(=O)c2ccccc2)cc1
COc1ccc(-c2onc(C(=O)c3ccc([N+](=O)[O-])cc3)c2S(=O)(=O)c2ccccc2)cc1
COc1ccc(-c2onc(SC(=O)Cc3ccc([N+](=O)[O-])cc3)c2S(=O)(=O)c2ccccc2)cc1
102
{ "fragment_index": 0, "new_substring": "S&C(=O)C&", "old_substring": "C56=O" }
Can you make molecule COc1ccc(-c2onc(C(=O)c3ccc([N+](=O)[O-])cc3)c2S(=O)(=O)c2ccccc2)cc1 less soluble in water? The output molecule should be similar to the input molecule.
COc1ccc(-c2onc(C(=O)CCCC(=O)c3ccc([N+](=O)[O-])cc3)c2S(=O)(=O)c2ccccc2)cc1
COc1ccc(-c2onc(C(=O)c3ccc([N+](=O)[O-])cc3)c2S(=O)(=O)c2ccccc2)cc1
COc1ccc(-c2onc(C(=O)CCCC(=O)c3ccc([N+](=O)[O-])cc3)c2S(=O)(=O)c2ccccc2)cc1
102
{ "fragment_index": 0, "new_substring": "C&(=O)CCCC&=O", "old_substring": "C56=O" }
Can you make molecule COc1ccc(-c2onc(C(=O)c3ccc([N+](=O)[O-])cc3)c2S(=O)(=O)c2ccccc2)cc1 less soluble in water? The output molecule should be similar to the input molecule.
COc1ccc(-c2onc(C(=O)CC(C)(C)c3ccc([N+](=O)[O-])cc3)c2S(=O)(=O)c2ccccc2)cc1
COc1ccc(-c2onc(C(=O)c3ccc([N+](=O)[O-])cc3)c2S(=O)(=O)c2ccccc2)cc1
COc1ccc(-c2onc(C(=O)CC(C)(C)c3ccc([N+](=O)[O-])cc3)c2S(=O)(=O)c2ccccc2)cc1
102
{ "fragment_index": 0, "new_substring": "C&(=O)CC&(C)C", "old_substring": "C56=O" }
Can you make molecule COc1ccc(-c2onc(C(=O)c3ccc([N+](=O)[O-])cc3)c2S(=O)(=O)c2ccccc2)cc1 less soluble in water? The output molecule should be similar to the input molecule.
COc1ccc(-c2onc(C[S@+]([O-])CCCc3ccc([N+](=O)[O-])cc3)c2S(=O)(=O)c2ccccc2)cc1
COc1ccc(-c2onc(C(=O)c3ccc([N+](=O)[O-])cc3)c2S(=O)(=O)c2ccccc2)cc1
COc1ccc(-c2onc(C[S@+]([O-])CCCc3ccc([N+](=O)[O-])cc3)c2S(=O)(=O)c2ccccc2)cc1
102
{ "fragment_index": 0, "new_substring": "C&[S@](=O)CCC&", "old_substring": "C56=O" }
Can you make molecule COc1ccc(-c2onc(C(=O)c3ccc([N+](=O)[O-])cc3)c2S(=O)(=O)c2ccccc2)cc1 less soluble in water? The output molecule should be similar to the input molecule.
COc1ccc(-c2onc(C(=O)CCC(C)(C)c3ccc([N+](=O)[O-])cc3)c2S(=O)(=O)c2ccccc2)cc1
COc1ccc(-c2onc(C(=O)c3ccc([N+](=O)[O-])cc3)c2S(=O)(=O)c2ccccc2)cc1
COc1ccc(-c2onc(C(=O)CCC(C)(C)c3ccc([N+](=O)[O-])cc3)c2S(=O)(=O)c2ccccc2)cc1
102
{ "fragment_index": 0, "new_substring": "C&(=O)CCC&(C)C", "old_substring": "C56=O" }
Can you make molecule CCC1=NN(c2cc(F)c(F)c(F)c2)C(=O)C1 less soluble in water? The output molecule should be similar to the input molecule.
Fc1cc(CCC2=CN=NC2)cc(F)c1F
CCC1=NN(c2cc(F)c(F)c(F)c2)C(=O)C1
Fc1cc(CCC2=CN=NC2)cc(F)c1F
102
{ "fragment_index": 0, "new_substring": "C&CC1=CN=NC1", "old_substring": "CCC1=NN3C(=O)C1" }
Can you make molecule CCC1=NN(c2cc(F)c(F)c(F)c2)C(=O)C1 less soluble in water? The output molecule should be similar to the input molecule.
CC(C)=NNC(=O)Sc1cc(F)c(F)c(F)c1
CCC1=NN(c2cc(F)c(F)c(F)c2)C(=O)C1
CC(C)=NNC(=O)Sc1cc(F)c(F)c(F)c1
102
{ "fragment_index": 0, "new_substring": "CC(C)=NNC(=O)S&", "old_substring": "CCC1=NN3C(=O)C1" }
Can you make molecule CCC1=NN(c2cc(F)c(F)c(F)c2)C(=O)C1 less soluble in water? The output molecule should be similar to the input molecule.
O=C1C=C(Cc2cc(F)c(F)c(F)c2)CCC1
CCC1=NN(c2cc(F)c(F)c(F)c2)C(=O)C1
O=C1C=C(Cc2cc(F)c(F)c(F)c2)CCC1
102
{ "fragment_index": 0, "new_substring": "C&C1=CC(=O)CCC1", "old_substring": "CCC1=NN3C(=O)C1" }
Can you make molecule CCC1=NN(c2cc(F)c(F)c(F)c2)C(=O)C1 less soluble in water? The output molecule should be similar to the input molecule.
CCC1=NO[C@H](c2cc(F)c(F)c(F)c2)C1
CCC1=NN(c2cc(F)c(F)c(F)c2)C(=O)C1
CCC1=NO[C@H](c2cc(F)c(F)c(F)c2)C1
102
{ "fragment_index": 0, "new_substring": "CCC1=NO[C@H]&C1", "old_substring": "CCC1=NN3C(=O)C1" }
Can you make molecule CCC1=NN(c2cc(F)c(F)c(F)c2)C(=O)C1 less soluble in water? The output molecule should be similar to the input molecule.
CCC1=C(C)[C@H](c2cc(F)c(F)c(F)c2)N=N1
CCC1=NN(c2cc(F)c(F)c(F)c2)C(=O)C1
CCC1=C(C)[C@H](c2cc(F)c(F)c(F)c2)N=N1
102
{ "fragment_index": 0, "new_substring": "CCC1=C(C)[C@H]&N=N1", "old_substring": "CCC1=NN3C(=O)C1" }
Can you make molecule CC[C@H](O)[C@@]1(C#N)CCC[C@H](C)C1 less soluble in water? The output molecule should be similar to the input molecule.
CC[C@H](CCO)C[C@@]1(C#N)CCC[C@H](C)C1
CC[C@H](O)[C@@]1(C#N)CCC[C@H](C)C1
CC[C@H](CCO)C[C@@]1(C#N)CCC[C@H](C)C1
102
{ "fragment_index": 0, "new_substring": "CC[C@@H](C&)CCO", "old_substring": "CC[C@@H]2O" }
Can you make molecule CC[C@H](O)[C@@]1(C#N)CCC[C@H](C)C1 less soluble in water? The output molecule should be similar to the input molecule.
CC[C@@H](C)CC(=O)[C@@]1(C#N)CCC[C@H](C)C1
CC[C@H](O)[C@@]1(C#N)CCC[C@H](C)C1
CC[C@@H](C)CC(=O)[C@@]1(C#N)CCC[C@H](C)C1
102
{ "fragment_index": 0, "new_substring": "CC[C@@H](C)CC&=O", "old_substring": "CC[C@@H]2O" }
Can you make molecule CC[C@H](O)[C@@]1(C#N)CCC[C@H](C)C1 less soluble in water? The output molecule should be similar to the input molecule.
CC[C@H](O)CC[C@@]1(C#N)CCC[C@H](C)C1
CC[C@H](O)[C@@]1(C#N)CCC[C@H](C)C1
CC[C@H](O)CC[C@@]1(C#N)CCC[C@H](C)C1
102
{ "fragment_index": 0, "new_substring": "CC[C@H](O)CC&", "old_substring": "CC[C@@H]2O" }
Can you make molecule CC[C@H](O)[C@@]1(C#N)CCC[C@H](C)C1 less soluble in water? The output molecule should be similar to the input molecule.
CC[C@@H](C)C(=O)C[C@@]1(C#N)CCC[C@H](C)C1
CC[C@H](O)[C@@]1(C#N)CCC[C@H](C)C1
CC[C@@H](C)C(=O)C[C@@]1(C#N)CCC[C@H](C)C1
102
{ "fragment_index": 0, "new_substring": "CC[C@@H](C)C(=O)C&", "old_substring": "CC[C@@H]2O" }
Can you make molecule CC[C@H](O)[C@@]1(C#N)CCC[C@H](C)C1 less soluble in water? The output molecule should be similar to the input molecule.
CCC[C@H](CO)[C@@]1(C#N)CCC[C@H](C)C1
CC[C@H](O)[C@@]1(C#N)CCC[C@H](C)C1
CCC[C@H](CO)[C@@]1(C#N)CCC[C@H](C)C1
102
{ "fragment_index": 0, "new_substring": "CCC[C@@H]&CO", "old_substring": "CC[C@@H]2O" }
Can you make molecule COC(=O)C=CC(=O)Nc1cc(C)cc(C)c1 less soluble in water? The output molecule should be similar to the input molecule.
Cc1cc(C)cc(NC(=O)C=CC(=O)C2OCc3ccccc3CO2)c1
COC(=O)C=CC(=O)Nc1cc(C)cc(C)c1
Cc1cc(C)cc(NC(=O)C=CC(=O)C2OCc3ccccc3CO2)c1
102
{ "fragment_index": 0, "new_substring": "C1&OCc2ccccc2CO1", "old_substring": "CO2" }
Can you make molecule COC(=O)C=CC(=O)Nc1cc(C)cc(C)c1 less soluble in water? The output molecule should be similar to the input molecule.
Cc1cc(C)cc(NC(=O)C=CC(=O)C2(O)Cc3ccccc3C2)c1
COC(=O)C=CC(=O)Nc1cc(C)cc(C)c1
Cc1cc(C)cc(NC(=O)C=CC(=O)C2(O)Cc3ccccc3C2)c1
102
{ "fragment_index": 0, "new_substring": "C1&(O)Cc2ccccc2C1", "old_substring": "CO2" }
Can you make molecule COC(=O)C=CC(=O)Nc1cc(C)cc(C)c1 less soluble in water? The output molecule should be similar to the input molecule.
Cc1cc(C)cc(NC(=O)C=CC(=O)C2=CC3=NN3C[C@@H](C)CO2)c1
COC(=O)C=CC(=O)Nc1cc(C)cc(C)c1
Cc1cc(C)cc(NC(=O)C=CC(=O)C2=CC3=NN3C[C@@H](C)CO2)c1
102
{ "fragment_index": 0, "new_substring": "C[C@H]1COc2cc&nn2C1", "old_substring": "CO2" }
Can you make molecule COC(=O)C=CC(=O)Nc1cc(C)cc(C)c1 less soluble in water? The output molecule should be similar to the input molecule.
Cc1cc(C)cc(NC(=O)C=CC(=O)N2CCOC23CCCCC3)c1
COC(=O)C=CC(=O)Nc1cc(C)cc(C)c1
Cc1cc(C)cc(NC(=O)C=CC(=O)N2CCOC23CCCCC3)c1
102
{ "fragment_index": 0, "new_substring": "N1&CCOC12CCCCC2", "old_substring": "CO2" }
Can you make molecule COC(=O)C=CC(=O)Nc1cc(C)cc(C)c1 less soluble in water? The output molecule should be similar to the input molecule.
Cc1cc(C)cc(NC(=O)C=CC(=O)N2CCOC3(CCC3)C2)c1
COC(=O)C=CC(=O)Nc1cc(C)cc(C)c1
Cc1cc(C)cc(NC(=O)C=CC(=O)N2CCOC3(CCC3)C2)c1
102
{ "fragment_index": 0, "new_substring": "N1&CCOC2(CCC2)C1", "old_substring": "CO2" }
Can you make molecule CCOC(=O)[C@H]1CCCN(C(=O)c2ccco2)C1 less soluble in water? The output molecule should be similar to the input molecule.
CCOC(=O)[C@H]1CCCN(SC(=O)Cc2ccco2)C1
CCOC(=O)[C@H]1CCCN(C(=O)c2ccco2)C1
CCOC(=O)[C@H]1CCCN(SC(=O)Cc2ccco2)C1
102
{ "fragment_index": 0, "new_substring": "S&C(=O)C&", "old_substring": "C46=O" }
Can you make molecule CCOC(=O)[C@H]1CCCN(C(=O)c2ccco2)C1 less soluble in water? The output molecule should be similar to the input molecule.
CCOC(=O)[C@H]1CCCN(C(=O)CCCC(=O)c2ccco2)C1
CCOC(=O)[C@H]1CCCN(C(=O)c2ccco2)C1
CCOC(=O)[C@H]1CCCN(C(=O)CCCC(=O)c2ccco2)C1
102
{ "fragment_index": 0, "new_substring": "C&(=O)CCCC&=O", "old_substring": "C46=O" }
Can you make molecule CCOC(=O)[C@H]1CCCN(C(=O)c2ccco2)C1 less soluble in water? The output molecule should be similar to the input molecule.
CCOC(=O)[C@H]1CCCN(C(=O)CC(C)(C)c2ccco2)C1
CCOC(=O)[C@H]1CCCN(C(=O)c2ccco2)C1
CCOC(=O)[C@H]1CCCN(C(=O)CC(C)(C)c2ccco2)C1
102
{ "fragment_index": 0, "new_substring": "C&(=O)CC&(C)C", "old_substring": "C46=O" }
Can you make molecule CCOC(=O)[C@H]1CCCN(C(=O)c2ccco2)C1 less soluble in water? The output molecule should be similar to the input molecule.
CCOC(=O)[C@H]1CCCN(C(=O)CCC(C)(C)c2ccco2)C1
CCOC(=O)[C@H]1CCCN(C(=O)c2ccco2)C1
CCOC(=O)[C@H]1CCCN(C(=O)CCC(C)(C)c2ccco2)C1
102
{ "fragment_index": 0, "new_substring": "C&(=O)CCC&(C)C", "old_substring": "C46=O" }
Can you make molecule CCOC(=O)[C@H]1CCCN(C(=O)c2ccco2)C1 less soluble in water? The output molecule should be similar to the input molecule.
CCOC(=O)[C@H]1CCCN(SC(=O)[C@@H](C)c2ccco2)C1
CCOC(=O)[C@H]1CCCN(C(=O)c2ccco2)C1
CCOC(=O)[C@H]1CCCN(SC(=O)[C@@H](C)c2ccco2)C1
102
{ "fragment_index": 0, "new_substring": "S&C(=O)[C@H]&C", "old_substring": "C46=O" }