prompt stringlengths 110 248 | input_smiles stringlengths 9 109 | output_smiles stringlengths 2 131 | task_id int64 101 206 | action_type stringclasses 3
values | success bool 1
class |
|---|---|---|---|---|---|
Can you make molecule CC[NH+](Cc1ccccn1)[C@H]1CS(=O)(=O)C[C@@H]1N lower permeability? The output molecule should be similar to the input molecule. | CC[NH+](Cc1ccccn1)[C@H]1CS(=O)(=O)C[C@@H]1N | CN1CCN([NH+](Cc2ccccn2)[C@H]2CS(=O)(=O)C[C@@H]2N)C2=NN=C2C1 | 106 | replace | true |
Can you make molecule CC[NH+]1CCC[C@@H]1CNC(=O)[C@@H]1CCC(=O)N(c2ccc(C)c(C)c2)C1 less soluble in water? The output molecule should be similar to the input molecule. | CC[NH+]1CCC[C@@H]1CNC(=O)[C@@H]1CCC(=O)N(c2ccc(C)c(C)c2)C1 | CC[NH+]1CCC[C@@H]1c1cnc2ccc(CNC(=O)[C@@H]3CCC(=O)N(c4ccc(C)c(C)c4)C3)nn2c1=O | 102 | insert | true |
Can you make molecule O=C(Nc1nc2ccccc2s1)c1ccc(N2CCCCC2)c([N+](=O)[O-])c1 with more hydrogen bond donors? The output molecule should be similar to the input molecule. | O=C(Nc1nc2ccccc2s1)c1ccc(N2CCCCC2)c([N+](=O)[O-])c1 | O=C(C=Nc1nc2ccccc2s1)NNC(=S)Nc1ccc(N2CCCCC2)c([N+](=O)[O-])c1 | 108 | replace | true |
Can you make molecule CC1=C(C(=O)OCC(C)C)[C@@H](c2ccc(-n3cccn3)cc2)NC(=S)N1 more soluble in water and more hydrogen bond acceptors? The output molecule should be similar to the input molecule. | CC1=C(C(=O)OCC(C)C)[C@@H](c2ccc(-n3cccn3)cc2)NC(=S)N1 | CC1=C(C(=O)OCC(C)C)[C@@H](c2ccc(-c3nnc(-n4cccn4)n(N)c3=O)cc2)NC(=S)N1 | 201 | insert | true |
Can you make molecule CS(=O)(=O)Cc1ccccc1NCC(=O)N1CCc2sccc2C1 lower permeability? The output molecule should be similar to the input molecule. | CS(=O)(=O)Cc1ccccc1NCC(=O)N1CCc2sccc2C1 | CS(=O)(=O)Cc1nnc(-c2ccccc2NCC(=O)N2CCc3sccc3C2)c(=O)n1N | 106 | insert | true |
Can you make molecule NC(=O)NCc1ccc(NC(=O)c2cc(Cl)ccc2O)cc1 with more hydrogen bond acceptors? The output molecule should be similar to the input molecule. | NC(=O)NCc1ccc(NC(=O)c2cc(Cl)ccc2O)cc1 | Cc1nc(C(N)=O)cn1NCc1ccc(NC(=O)c2cc(Cl)ccc2O)cc1 | 107 | insert | true |
Can you make molecule O=S(=O)([N-]c1ccon1)c1ccc(F)c(F)c1 more soluble in water? The output molecule should be similar to the input molecule. | O=S(=O)([N-]c1ccon1)c1ccc(F)c(F)c1 | O=S(=O)([N-]c1ncon1)c1ccc(F)c(F)c1 | 101 | replace | true |
Can you make molecule CC(=O)Nc1ccc(Nc2nc3ccccc3nc2[N-]S(=O)(=O)c2cccc(Cl)c2)cc1 more soluble in water? The output molecule should be similar to the input molecule. | CC(=O)Nc1ccc(Nc2nc3ccccc3nc2[N-]S(=O)(=O)c2cccc(Cl)c2)cc1 | CC(=O)Nc1ccc(Nc2nc3ccccc3nc2-c2cc([N-]S(=O)(=O)c3cccc(Cl)c3)nc(NN)n2)cc1 | 101 | insert | true |
Can you make molecule Fc1ccc(C[C@@H](Cl)c2cccnc2)cc1F more soluble in water and more hydrogen bond donors? The output molecule should be similar to the input molecule. | Fc1ccc(C[C@@H](Cl)c2cccnc2)cc1F | Oc1ccc(O)c([C@H](Cl)Cc2ccc(F)c(F)c2)c1 | 203 | replace | true |
Can you make molecule Cc1ccc([C@H]2CN(S(=O)(=O)c3cccnc3)C[C@@H]2[NH3+])o1 less soluble in water? The output molecule should be similar to the input molecule. | Cc1ccc([C@H]2CN(S(=O)(=O)c3cccnc3)C[C@@H]2[NH3+])o1 | Cc1ccc([C@H]2CC[C@H](S(=O)(=O)c3cccnc3)C2)o1 | 102 | replace | true |
Can you make molecule C[C@@H](C(=O)Nc1ccc(Cl)cn1)n1cc([N+](=O)[O-])cn1 lower permeability? The output molecule should be similar to the input molecule. | C[C@@H](C(=O)Nc1ccc(Cl)cn1)n1cc([N+](=O)[O-])cn1 | C[C@@H](/C=N/NC(=O)Nc1ccc(Cl)cn1)n1cc([N+](=O)[O-])cn1 | 106 | replace | true |
Can you make molecule C[NH+](CCC1C[C@H]2CC[C@@H](C1)[NH2+]2)Cc1ccccc1Br more soluble in water and lower permeability? The output molecule should be similar to the input molecule. | C[NH+](CCC1C[C@H]2CC[C@@H](C1)[NH2+]2)Cc1ccccc1Br | C[NH+](CCS(=O)(=O)C1C[C@H]2CC[C@@H](C1)[NH2+]2)Cc1ccccc1Br | 206 | replace | true |
Can you make molecule Cc1cc(C)c(C(=O)N(CC2CC[NH+](CCc3ccccc3C)CC2)C2CCCC2)c(=O)[nH]1 less like a drug? The output molecule should be similar to the input molecule. | Cc1cc(C)c(C(=O)N(CC2CC[NH+](CCc3ccccc3C)CC2)C2CCCC2)c(=O)[nH]1 | Cc1cc(C)c(C(=O)N(CC2CC[NH+](CCc3ccccc3C)CC2)C2(O)CCCCC2)c(=O)[nH]1 | 104 | replace | true |
Can you make molecule CCc1c(C)sc(NC(=O)CC[C@@H]2Cc3ccccc3NC2=O)c1C#N lower permeability? The output molecule should be similar to the input molecule. | CCc1c(C)sc(NC(=O)CC[C@@H]2Cc3ccccc3NC2=O)c1C#N | CCc1c(C)sc(C(=O)NONC(=O)CC[C@@H]2Cc3ccccc3NC2=O)c1C#N | 106 | insert | true |
Can you make molecule CC[NH+]1CCN(c2nc3ncn(CC(=O)N4CCN(c5ccc(F)cc5)CC4)c(=O)c3s2)CC1 more soluble in water? The output molecule should be similar to the input molecule. | CC[NH+]1CCN(c2nc3ncn(CC(=O)N4CCN(c5ccc(F)cc5)CC4)c(=O)c3s2)CC1 | CC[NH+]1CCN(c2nc3ncn(CC(=O)N4CCN(c5ccc(F)c(N)c5)CC4)c(=O)c3s2)CC1 | 101 | replace | true |
Can you make molecule O=S1(=O)CC[C@@H](CF)[C@@]12CC[NH2+]C2 less soluble in water? The output molecule should be similar to the input molecule. | O=S1(=O)CC[C@@H](CF)[C@@]12CC[NH2+]C2 | C[C@@H]1CC[C@@H](CF)CN1[C@@H]1CCS(=O)(=O)[C@]12CC[NH2+]C2 | 102 | insert | true |
Can you make molecule O=C(Cn1cnc2cc(F)c(F)cc21)N(C1CCCC1)[C@@H]1CCS(=O)(=O)C1 lower permeability? The output molecule should be similar to the input molecule. | O=C(Cn1cnc2cc(F)c(F)cc21)N(C1CCCC1)[C@@H]1CCS(=O)(=O)C1 | O=C(CN(C1CCCC1)[C@@H]1CCS(=O)(=O)C1)C(=O)n1cnc2cc(F)c(F)cc21 | 106 | replace | true |
Can you make molecule CN1CCC[C@@]2(CC[NH+](Cc3ccc4c(c3)Cc3ccccc3-4)C2)C1=O less soluble in water? The output molecule should be similar to the input molecule. | CN1CCC[C@@]2(CC[NH+](Cc3ccc4c(c3)Cc3ccccc3-4)C2)C1=O | Cc1cc([NH+]2CC[C@@]3(CCCN(C)C3=O)C2)c(C)n1Cc1ccc2c(c1)Cc1ccccc1-2 | 102 | insert | true |
Can you make molecule O=C(CCN1CCCCO1)NC[C@@H]1N=NC2=C1CCC2 less soluble in water and more hydrogen bond acceptors? The output molecule should be similar to the input molecule. | O=C(CCN1CCCCO1)NC[C@@H]1N=NC2=C1CCC2 | Cc1cc(C(=O)CCN2CCCCO2)nn1NC[C@@H]1N=NC2=C1CCC2 | 202 | insert | true |
Can you make molecule O=C1CCCCN1CCC(=O)N1CCO[C@H](c2ccc(Cl)cc2)C1 more soluble in water? The output molecule should be similar to the input molecule. | O=C1CCCCN1CCC(=O)N1CCO[C@H](c2ccc(Cl)cc2)C1 | Cc1ccc([C@@H]2CN(C(=O)CCN3CCCCC3=O)CCO2)c(NN)c1 | 101 | replace | true |
Can you make molecule O=C(N[C@@H]1CCSc2c(F)cccc21)c1cnc([C@H]2CCCO2)s1 more soluble in water? The output molecule should be similar to the input molecule. | O=C(N[C@@H]1CCSc2c(F)cccc21)c1cnc([C@H]2CCCO2)s1 | O=C(N[C@@H]1CCSc2c(F)cccc21)c1cnc(N2CCC[C@@](O)([C@H]3CCCO3)C2)s1 | 101 | insert | true |
Can you make molecule Cc1cc(N2CCOCC2)ccc1NC(=O)N[C@@H](C)[C@@H](C)CO less soluble in water and more hydrogen bond donors? The output molecule should be similar to the input molecule. | Cc1cc(N2CCOCC2)ccc1NC(=O)N[C@@H](C)[C@@H](C)CO | Cc1cc(N2CCOCC2)ccc1NC(=O)NNc1ccc(N[C@@H](C)[C@@H](C)CO)cc1 | 204 | replace | true |
Can you make molecule CC(C)(C)C(=O)NCCC(=O)N[C@@H](c1ccc(F)cc1)[C@H]1CCCO1 with more hydrogen bond donors? The output molecule should be similar to the input molecule. | CC(C)(C)C(=O)NCCC(=O)N[C@@H](c1ccc(F)cc1)[C@H]1CCCO1 | CC(C)(C)C(=O)NCCC(=O)N[C@@H](NC1=NN[C@H](c2ccc(F)cc2)S1)[C@H]1CCCO1 | 108 | insert | true |
Can you make molecule CCCNC(=O)CNC(=O)N[C@@H](c1ccc(F)cc1)c1cccs1 less soluble in water and more hydrogen bond acceptors? The output molecule should be similar to the input molecule. | CCCNC(=O)CNC(=O)N[C@@H](c1ccc(F)cc1)c1cccs1 | CC1(NC(=O)CNC(=O)N[C@@H](c2ccc(F)cc2)c2cccs2)SCCS1 | 202 | replace | true |
Can you make molecule CCOc1ccc([C@H]([NH3+])c2n[nH]c(-c3cccc(F)c3)n2)cc1OCC less soluble in water? The output molecule should be similar to the input molecule. | CCOc1ccc([C@H]([NH3+])c2n[nH]c(-c3cccc(F)c3)n2)cc1OCC | CCOc1ccc([C@H]([NH3+])c2cccc(F)c2)cc1OCC | 102 | delete | true |
Can you make molecule Cc1ncccc1C(=O)NCCCO more soluble in water and higher permeability? The output molecule should be similar to the input molecule. | Cc1ncccc1C(=O)NCCCO | Cc1ncccc1[NH+]1CCS[C@@H](NCCCO)C1 | 205 | replace | true |
Can you make molecule O=C(NCCc1c[nH]c2ccccc12)C1CCN(S(=O)(=O)c2ccc(F)cc2)CC1 more soluble in water and more hydrogen bond donors? The output molecule should be similar to the input molecule. | O=C(NCCc1c[nH]c2ccccc12)C1CCN(S(=O)(=O)c2ccc(F)cc2)CC1 | O=C(/C=C/NNC(=O)C1CCN(S(=O)(=O)c2ccc(F)cc2)CC1)NCCc1c[nH]c2ccccc12 | 203 | replace | true |
Can you make molecule CC(=O)[C@@H](C)Sc1nc2sc3c(c2c(=O)n1-c1ccccc1)CCCC3 more soluble in water and more hydrogen bond donors? The output molecule should be similar to the input molecule. | CC(=O)[C@@H](C)Sc1nc2sc3c(c2c(=O)n1-c1ccccc1)CCCC3 | CC(=O)[C@@H](C)Sc1nc2sc3c(c2c(=O)n1[C@H]1N[C@@H](c2ccccc2)NO1)CCCC3 | 203 | insert | true |
Can you make molecule O=C([O-])c1ccc(N2C(=O)C[C@H](Nc3ccccc3[N+](=O)[O-])C2=O)cc1 more soluble in water and higher permeability? The output molecule should be similar to the input molecule. | O=C([O-])c1ccc(N2C(=O)C[C@H](Nc3ccccc3[N+](=O)[O-])C2=O)cc1 | C[NH+]1CCC[NH+](c2ccc(N3C(=O)C[C@H](Nc4ccccc4[N+](=O)[O-])C3=O)cc2)CC1 | 205 | replace | true |
Can you make molecule Cn1cnnc1-c1cncc(NCc2cccc(-c3ccncc3)c2)c1 less soluble in water and more hydrogen bond acceptors? The output molecule should be similar to the input molecule. | Cn1cnnc1-c1cncc(NCc2cccc(-c3ccncc3)c2)c1 | Cc1c(-c2cccc(CNc3cncc(-c4nncn4C)c3)c2)noc1-c1ccncc1 | 202 | insert | true |
Can you make molecule COc1ccc(Oc2cc(CNC(=O)c3cc[n+]([O-])cc3)ccn2)cc1 more soluble in water? The output molecule should be similar to the input molecule. | COc1ccc(Oc2cc(CNC(=O)c3cc[n+]([O-])cc3)ccn2)cc1 | COc1ccc(Oc2cc(CNC(=O)CN(C)Oc3cc[n+]([O-])cc3)ccn2)cc1 | 101 | replace | true |
Can you make molecule CO[C@@H](CNC(=O)NC[C@H](O)c1ccsc1)c1cccc(Cl)c1 more soluble in water? The output molecule should be similar to the input molecule. | CO[C@@H](CNC(=O)NC[C@H](O)c1ccsc1)c1cccc(Cl)c1 | CO[C@@H](CNC(=O)NC[C@H](O)c1ccsc1)ONC(=O)c1cccc(Cl)c1 | 101 | insert | true |
Can you make molecule CCN1CCc2nc[nH]c2C12CC[NH+](Cc1c(C)nc3sccn13)CC2 with more hydrogen bond acceptors? The output molecule should be similar to the input molecule. | CCN1CCc2nc[nH]c2C12CC[NH+](Cc1c(C)nc3sccn13)CC2 | COCSN1CCc2nc[nH]c2C12CC[NH+](Cc1c(C)nc3sccn13)CC2 | 107 | replace | true |
Can you make molecule CCN(C1CC[NH+](Cc2cc(-c3ccccc3)[nH]n2)CC1)S(C)(=O)=O less soluble in water and more hydrogen bond donors? The output molecule should be similar to the input molecule. | CCN(C1CC[NH+](Cc2cc(-c3ccccc3)[nH]n2)CC1)S(C)(=O)=O | CCN(C(=O)NNc1ccsc1S(C)(=O)=O)C1CC[NH+](Cc2cc(-c3ccccc3)[nH]n2)CC1 | 204 | insert | true |
Can you make molecule Cc1cc(C[NH+]2CCC[C@@H]([C@H](O)c3nccn3C)C2)c(C)n1CC(C)C with more hydrogen bond donors? The output molecule should be similar to the input molecule. | Cc1cc(C[NH+]2CCC[C@@H]([C@H](O)c3nccn3C)C2)c(C)n1CC(C)C | Cc1cc(C[NH+]2CCC[C@@H]([C@H](O)c3nccn3C)C2)c(C)n1CC/[NH+]=C(\N)NCC(C)C | 108 | insert | true |
Can you make molecule C[C@@H]1CCC[C@@H](C)N1C(=O)C[NH+]1CCN(c2nccs2)CC1 more soluble in water and more hydrogen bond donors? The output molecule should be similar to the input molecule. | C[C@@H]1CCC[C@@H](C)N1C(=O)C[NH+]1CCN(c2nccs2)CC1 | C[C@@H]1CCC[C@@H](C)N1c1cc(C(=O)C[NH+]2CCN(c3nccs3)CC2)nc(NN)n1 | 203 | insert | true |
Can you make molecule Cc1cccc(NC(=O)N2CCC(C(=O)NCc3nc(C)no3)CC2)c1 less soluble in water? The output molecule should be similar to the input molecule. | Cc1cccc(NC(=O)N2CCC(C(=O)NCc3nc(C)no3)CC2)c1 | Cc1cccc(NC(=O)C[C@@H](Br)N2CCC(C(=O)NCc3nc(C)no3)CC2)c1 | 102 | replace | true |
Can you make molecule Cc1ccc(N2C(=O)C[C@@H](C(=O)Nc3cccc(C(N)=O)c3)[C@H]2c2cccs2)cc1 with more hydrogen bond donors? The output molecule should be similar to the input molecule. | Cc1ccc(N2C(=O)C[C@@H](C(=O)Nc3cccc(C(N)=O)c3)[C@H]2c2cccs2)cc1 | Cc1c(Cl)cccc1NNC(=O)N1C(=O)C[C@@H](C(=O)Nc2cccc(C(N)=O)c2)[C@H]1c1cccs1 | 108 | replace | true |
Can you make molecule CC(=O)c1sc(N2C(=O)c3oc4ccc(Cl)cc4c(=O)c3[C@@H]2c2ccc(F)cc2)nc1C more soluble in water? The output molecule should be similar to the input molecule. | CC(=O)c1sc(N2C(=O)c3oc4ccc(Cl)cc4c(=O)c3[C@@H]2c2ccc(F)cc2)nc1C | CC(=O)c1sc(ONC(=O)N2C(=O)c3oc4ccc(Cl)cc4c(=O)c3[C@@H]2c2ccc(F)cc2)nc1C | 101 | insert | true |
Can you make molecule C[C@@H]1CN(C(=O)NCc2ccc(N3CC[NH+](CC4CC4)CC3)cc2)CCO1 more soluble in water? The output molecule should be similar to the input molecule. | C[C@@H]1CN(C(=O)NCc2ccc(N3CC[NH+](CC4CC4)CC3)cc2)CCO1 | C[C@@H]1CN(C(=O)NCc2ccc(N3CC[NH+](NC(=S)NNC(=S)NCC4CC4)CC3)cc2)CCO1 | 101 | insert | true |
Can you make molecule CCCCOC(=O)CN1CC(=O)N2CCCC[C@@H]2C1=O less soluble in water and more hydrogen bond acceptors? The output molecule should be similar to the input molecule. | CCCCOC(=O)CN1CC(=O)N2CCCC[C@@H]2C1=O | CCCCc1cc(C)c2ccc(OC(=O)CN3CC(=O)N4CCCC[C@@H]4C3=O)nc2n1 | 202 | insert | true |
Can you make molecule O=C(Nc1nc[nH]n1)c1cccnc1Nc1cccc(F)c1 less like a drug? The output molecule should be similar to the input molecule. | O=C(Nc1nc[nH]n1)c1cccnc1Nc1cccc(F)c1 | O=C1CSC2=NN=C2N(Nc2nc[nH]n2)N1Cc1cccnc1Nc1cccc(F)c1 | 104 | replace | true |
Can you make molecule C[C@@H]1C[NH+](CC(=O)c2ccco2)C[C@@H]1C less soluble in water and more hydrogen bond donors? The output molecule should be similar to the input molecule. | C[C@@H]1C[NH+](CC(=O)c2ccco2)C[C@@H]1C | C[C@@H]1C[NH+](CC(=O)c2cc(NN)c(Br)cc2Br)C[C@@H]1C | 204 | replace | true |
Can you make molecule Cc1ccc(-n2nnc3c(N4CCN(C(=O)COc5ccc6ccccc6c5)CC4)ncnc32)cc1 less soluble in water and more hydrogen bond acceptors? The output molecule should be similar to the input molecule. | Cc1ccc(-n2nnc3c(N4CCN(C(=O)COc5ccc6ccccc6c5)CC4)ncnc32)cc1 | Cc1ccc(-c2c(O)ccc3occ(-n4nnc5c(N6CCN(C(=O)COc7ccc8ccccc8c7)CC6)ncnc54)c23)cc1 | 202 | insert | true |
Can you make molecule CN(Cc1cnccn1)c1ncccc1S(N)(=O)=O higher permeability? The output molecule should be similar to the input molecule. | CN(Cc1cnccn1)c1ncccc1S(N)(=O)=O | CN(Cc1cnccc1Cl)c1ncccc1S(N)(=O)=O | 105 | replace | true |
Can you make molecule O=C(OCc1cc(-c2ccccc2)on1)c1ccc(F)cc1 with more hydrogen bond donors? The output molecule should be similar to the input molecule. | O=C(OCc1cc(-c2ccccc2)on1)c1ccc(F)cc1 | N/C(NCOC(=O)c1ccc(F)cc1)=[NH+]\CCc1cc(-c2ccccc2)on1 | 108 | insert | true |
Can you make molecule C=CCN(Cc1ccccc1)C(=O)Nc1ccc2c(c1)COC2 more soluble in water and higher permeability? The output molecule should be similar to the input molecule. | C=CCN(Cc1ccccc1)C(=O)Nc1ccc2c(c1)COC2 | C=CCN(Cc1ccccc1)[NH+]1CC=C(CCNc2ccc3c(c2)COC3)CC1 | 205 | replace | true |
Can you make molecule Cc1cc(C)nc(Nc2nc(CC(=O)N3CCC4(CC3)OCCO4)cs2)n1 more soluble in water and lower permeability? The output molecule should be similar to the input molecule. | Cc1cc(C)nc(Nc2nc(CC(=O)N3CCC4(CC3)OCCO4)cs2)n1 | Cc1cc(C)nc(Nc2nc(N3CCN(N4CCC5(CC4)OCCO5)C(=O)C3=O)cs2)n1 | 206 | replace | true |
Can you make molecule COc1ccsc1C(=O)N1CCc2c(cccc2N2CCOC2=O)C1 less like a drug? The output molecule should be similar to the input molecule. | COc1ccsc1C(=O)N1CCc2c(cccc2N2CCOC2=O)C1 | COc1ccsc1CC(=O)SN1CCc2c(cccc2N2CCOC2=O)C1 | 104 | replace | true |
Can you make molecule CC[C@H]1CCCCN1C(=O)CN1C(=O)CSC1=O more soluble in water and lower permeability? The output molecule should be similar to the input molecule. | CC[C@H]1CCCCN1C(=O)CN1C(=O)CSC1=O | CC[C@H]1CCCCN1C(=O)Cc1cc(N2C(=O)CSC2=O)nc(NN)n1 | 206 | insert | true |
Can you make molecule C[C@H]1CCN(C(=O)NC2CCC([NH+]3CCCCC3)CC2)[C@H](C)C1 less soluble in water and more hydrogen bond acceptors? The output molecule should be similar to the input molecule. | C[C@H]1CCN(C(=O)NC2CCC([NH+]3CCCCC3)CC2)[C@H](C)C1 | C[C@H]1CCN(C(=O)Nc2ccc3ncc(C4CCC([NH+]5CCCCC5)CC4)c(=O)n3n2)[C@H](C)C1 | 202 | insert | true |
Can you make molecule CC(C)N(C[C@H]1C[C@@H]1C)C(=O)Cc1c(F)cccc1F more soluble in water and lower permeability? The output molecule should be similar to the input molecule. | CC(C)N(C[C@H]1C[C@@H]1C)C(=O)Cc1c(F)cccc1F | C[C@H]1C[C@@H]1CN(C(=O)Cc1c(F)cccc1F)C(C)(C)CO | 206 | replace | true |
Can you make molecule CC[C@H](Cc1ccccc1)NC(=O)c1ccc(-c2nc(C)no2)cc1 less soluble in water? The output molecule should be similar to the input molecule. | CC[C@H](Cc1ccccc1)NC(=O)c1ccc(-c2nc(C)no2)cc1 | CC[C@H](Cc1ccccc1)Nc1ccc2ncc(C(=O)c3ccc(-c4nc(C)no4)cc3)c(=O)n2n1 | 102 | insert | true |
Can you make molecule Cc1cccc(CN(Cc2cccc(C)n2)C(=O)NCC[S@@+](C)[O-])n1 more soluble in water and more hydrogen bond donors? The output molecule should be similar to the input molecule. | Cc1cccc(CN(Cc2cccc(C)n2)C(=O)NCC[S@@+](C)[O-])n1 | Cc1cccc(C[C@H]2NN[C@@H](C(=O)NCC[S@@+](C)[O-])N2Cc2cccc(C)n2)n1 | 203 | replace | true |
Can you make molecule Cc1cccc(C2=CCN(C(=O)C3CCN(C(=O)C4CC4)CC3)CC2)c1 with more hydrogen bond donors? The output molecule should be similar to the input molecule. | Cc1cccc(C2=CCN(C(=O)C3CCN(C(=O)C4CC4)CC3)CC2)c1 | Cc1cccc(C2=CCN(C(=O)C3CCN(C(=O)NNc4nc(C5CC5)no4)CC3)CC2)c1 | 108 | replace | true |
Can you make molecule O=C(Nc1ccc2ncccc2c1)[C@@H]1CSCN1C(=O)c1ccc(Cl)cc1 more soluble in water and more hydrogen bond acceptors? The output molecule should be similar to the input molecule. | O=C(Nc1ccc2ncccc2c1)[C@@H]1CSCN1C(=O)c1ccc(Cl)cc1 | NNc1nc(C(=O)c2ccc(Cl)cc2)cc(N2CSC[C@H]2C(=O)Nc2ccc3ncccc3c2)n1 | 201 | insert | true |
Can you make molecule CC[NH2+][C@H](Cc1ncnn1C)C1([NH+]2CCCC2)CCCC1 more soluble in water and lower permeability? The output molecule should be similar to the input molecule. | CC[NH2+][C@H](Cc1ncnn1C)C1([NH+]2CCCC2)CCCC1 | CC[NH2+][C@H](CONC(=O)c1ncnn1C)C1([NH+]2CCCC2)CCCC1 | 206 | insert | true |
Can you make molecule COc1ccc2c(c1)=C1CCN[C@H]([C@@H]3C(=O)N(CC(C)C)C(=O)N(CC(C)C)[C@H]3O)[C@H]1[NH+]=2 higher permeability? The output molecule should be similar to the input molecule. | COc1ccc2c(c1)=C1CCN[C@H]([C@@H]3C(=O)N(CC(C)C)C(=O)N(CC(C)C)[C@H]3O)[C@H]1[NH+]=2 | COc1ccc2c(c1)=C1CCN[C@H]([C@@H]3C=CC(CC(C)C)(CC(C)C)O3)[C@H]1[NH+]=2 | 105 | replace | true |
Can you make molecule CCc1nn(C)cc1CNc1cc2c(cc1Cl)OCO2 less soluble in water and more hydrogen bond acceptors? The output molecule should be similar to the input molecule. | CCc1nn(C)cc1CNc1cc2c(cc1Cl)OCO2 | CCc1nn(C)cc1-c1sc(Nc2cc3c(cc2Cl)OCO3)nc1C | 202 | replace | true |
Can you make molecule CCC[C@@](C)([NH3+])c1nc([C@H]2CSCCS2)no1 less soluble in water and more hydrogen bond acceptors? The output molecule should be similar to the input molecule. | CCC[C@@](C)([NH3+])c1nc([C@H]2CSCCS2)no1 | CCC[C@@](C)([NH3+])n1nnc2sc([C@H]3CSCCS3)cc2c1=O | 202 | replace | true |
Can you make molecule CCN(CC)C(=O)Nc1ccc(N2CCSCC2)cc1C lower permeability? The output molecule should be similar to the input molecule. | CCN(CC)C(=O)Nc1ccc(N2CCSCC2)cc1C | CCN(CC)C(=O)Nc1ccc(N2CCCNC2=O)cc1C | 106 | replace | true |
Can you make molecule CCOc1ccc(Cl)cc1C=C1NC(=O)N(CC(=O)Nc2ccccc2)C1=O more like a drug? The output molecule should be similar to the input molecule. | CCOc1ccc(Cl)cc1C=C1NC(=O)N(CC(=O)Nc2ccccc2)C1=O | CCOc1ccc(Cl)cc1C=NC1=NN(CC(=O)Nc2ccccc2)C(=O)C1 | 103 | replace | true |
Can you make molecule CCOC(=O)[C@@]1(C)CC[NH+](Cc2cccc3cn[nH]c23)C1 more soluble in water? The output molecule should be similar to the input molecule. | CCOC(=O)[C@@]1(C)CC[NH+](Cc2cccc3cn[nH]c23)C1 | CCOC(=O)c1cc([C@@]2(C)CC[NH+](Cc3cccc4cn[nH]c34)C2)nc(NN)n1 | 101 | insert | true |
Can you make molecule Cc1ccc2nc(NC(=O)[C@H]3CC(=O)N(Cc4ccccc4)C3)sc2c1 more soluble in water? The output molecule should be similar to the input molecule. | Cc1ccc2nc(NC(=O)[C@H]3CC(=O)N(Cc4ccccc4)C3)sc2c1 | Cc1ccc2nc(NC(=O)N/C(N)=[NH+]/CC[C@H]3CC(=O)N(Cc4ccccc4)C3)sc2c1 | 101 | insert | true |
Can you make molecule CCN(Cc1cnn(CC)c1)C(=O)c1ccncc1Cl lower permeability? The output molecule should be similar to the input molecule. | CCN(Cc1cnn(CC)c1)C(=O)c1ccncc1Cl | CCN(Cc1nn(CC)cc1O)C(=O)c1ccncc1Cl | 106 | replace | true |
Can you make molecule Cc1nn(C)c(=O)c(C(=O)N2C[C@@H](O)C[C@H]2c2cc(F)ccc2F)c1C higher permeability? The output molecule should be similar to the input molecule. | Cc1nn(C)c(=O)c(C(=O)N2C[C@@H](O)C[C@H]2c2cc(F)ccc2F)c1C | Cc1nn(C)c(=O)c(C(=O)c2cc(F)ccc2F)c1C | 105 | delete | true |
Can you make molecule O=C(Nc1ccccc1Cl)C1CCN(C(=O)c2cccc(F)c2)CC1 more soluble in water and more hydrogen bond acceptors? The output molecule should be similar to the input molecule. | O=C(Nc1ccccc1Cl)C1CCN(C(=O)c2cccc(F)c2)CC1 | Nn1c(Nc2ccccc2Cl)nnc(C(=O)C2CCN(C(=O)c3cccc(F)c3)CC2)c1=O | 201 | insert | true |
Can you make molecule NC(=O)CCN(C(=O)C1=Cc2cc(F)ccc2OC1)c1ccccc1 more soluble in water and more hydrogen bond acceptors? The output molecule should be similar to the input molecule. | NC(=O)CCN(C(=O)C1=Cc2cc(F)ccc2OC1)c1ccccc1 | NNC(=O)CC(=O)N(C(=O)C1=Cc2cc(F)ccc2OC1)c1ccccc1 | 201 | replace | true |
Can you make molecule Cc1ccc(-c2nc(C)c(C(=O)N[C@@H](c3ccc(F)cc3)[C@H]3CCCO3)s2)o1 less soluble in water and more hydrogen bond donors? The output molecule should be similar to the input molecule. | Cc1ccc(-c2nc(C)c(C(=O)N[C@@H](c3ccc(F)cc3)[C@H]3CCCO3)s2)o1 | Cc1ccc(-c2nc(C)c(C(=O)NC(=S)NN=C3CCC(N[C@@H](c4ccc(F)cc4)[C@H]4CCCO4)CC3)s2)o1 | 204 | insert | true |
Can you make molecule COCCn1cc[nH+]c1[C@H]1CCCN(c2cccc(C#N)n2)C1 more soluble in water and lower permeability? The output molecule should be similar to the input molecule. | COCCn1cc[nH+]c1[C@H]1CCCN(c2cccc(C#N)n2)C1 | COCCn1cc[nH+]c1-n1[nH+]c([C@H]2CCCN(c3cccc(C#N)n3)C2)c(C)c1N | 206 | insert | true |
Can you make molecule COc1ccc(OC)c(Nc2[nH+]cnc(N3CCCc4ccccc43)c2N)c1 more soluble in water? The output molecule should be similar to the input molecule. | COc1ccc(OC)c(Nc2[nH+]cnc(N3CCCc4ccccc43)c2N)c1 | COc1ccc(C(=O)NN)cc1Nc1[nH+]cnc(N2CCCc3ccccc32)c1N | 101 | replace | true |
Can you make molecule O=C(N[C@]1(C(F)(F)F)N=C(c2ccccc2)N(C[C@H]2CCCO2)C1=O)c1ccc(Cl)cc1 more soluble in water and more hydrogen bond donors? The output molecule should be similar to the input molecule. | O=C(N[C@]1(C(F)(F)F)N=C(c2ccccc2)N(C[C@H]2CCCO2)C1=O)c1ccc(Cl)cc1 | NNc1nc(N[C@]2(C(F)(F)F)N=C(c3ccccc3)N(C[C@H]3CCCO3)C2=O)cc(C(=O)c2ccc(Cl)cc2)n1 | 203 | insert | true |
Can you make molecule Cn1cccc(NC(=O)Cc2ccccc2Cl)c1=O less like a drug? The output molecule should be similar to the input molecule. | Cn1cccc(NC(=O)Cc2ccccc2Cl)c1=O | Cn1cccc(NC(=O)Cc2cc(-c3ccccc3Cl)c(Cl)cc2F)c1=O | 104 | insert | true |
Can you make molecule CCc1cccc(NC(=O)[C@@H](C)O/N=C(/N)C(F)(F)F)c1 less like a drug? The output molecule should be similar to the input molecule. | CCc1cccc(NC(=O)[C@@H](C)O/N=C(/N)C(F)(F)F)c1 | CCONC(=O)c1cccc(NC(=O)[C@@H](C)O/N=C(/N)C(F)(F)F)c1 | 104 | insert | true |
Can you make molecule C[C@H](/N=C(/Cc1ccccc1)C(=O)OC(C)(C)C)C(=O)[O-] more soluble in water? The output molecule should be similar to the input molecule. | C[C@H](/N=C(/Cc1ccccc1)C(=O)OC(C)(C)C)C(=O)[O-] | Cc1c(C/C(=N/[C@@H](C)C(=O)[O-])C(=O)OC(C)(C)C)[nH+]n(-c2ccccc2)c1N | 101 | insert | true |
Can you make molecule C[C@@H](NC(=O)NCCc1cc(F)cc(F)c1)[C@@H](O)c1ccc(Cl)cc1 more like a drug? The output molecule should be similar to the input molecule. | C[C@@H](NC(=O)NCCc1cc(F)cc(F)c1)[C@@H](O)c1ccc(Cl)cc1 | O=C(NCCc1cc(F)cc(F)c1)N[C@@H]1CCN(c2ccc(Cl)cc2)C1 | 103 | replace | true |
Can you make molecule O=C([C@H]1CC(c2ccccc2)=NO1)N1CCCSc2ccccc21 less like a drug? The output molecule should be similar to the input molecule. | O=C([C@H]1CC(c2ccccc2)=NO1)N1CCCSc2ccccc21 | NN1CCc2cccc(C(=O)[C@H]3CC(c4ccccc4)=NO3)c21 | 104 | replace | true |
Can you make molecule CCOc1ccc(CN2CC[C@@](F)(C(=O)OC)C2)nc1 more soluble in water? The output molecule should be similar to the input molecule. | CCOc1ccc(CN2CC[C@@](F)(C(=O)OC)C2)nc1 | CCOc1ccc(CN2CC[C@H](C(=O)OC)C(=O)C2)nc1 | 101 | replace | true |
Can you make molecule Cc1nn(-c2ccc(Cl)cc2)c(O)c1/C=N\c1nnc(-c2ccccc2)s1 with more hydrogen bond acceptors? The output molecule should be similar to the input molecule. | Cc1nn(-c2ccc(Cl)cc2)c(O)c1/C=N\c1nnc(-c2ccccc2)s1 | Cc1nn(-c2nc3cc(Cl)ccc3o2)c(O)c1/C=N\c1nnc(-c2ccccc2)s1 | 107 | replace | true |
Can you make molecule COCc1nc(C)cc(S[C@@H](C)C(=O)OC)n1 less soluble in water and more hydrogen bond acceptors? The output molecule should be similar to the input molecule. | COCc1nc(C)cc(S[C@@H](C)C(=O)OC)n1 | COC(=O)[C@H](C)Sc1cc(C)nc(SC(=S)N(C)OC)n1 | 202 | replace | true |
Can you make molecule CCC(=O)N[C@H]1CCCN(C(=O)N[C@H](C)C2CCCCC2)C1 with more hydrogen bond donors? The output molecule should be similar to the input molecule. | CCC(=O)N[C@H]1CCCN(C(=O)N[C@H](C)C2CCCCC2)C1 | CCC(=O)N[C@H]1CCCN(C(=O)N[C@H](C)NC2=CCNN2C(C)C)C1 | 108 | replace | true |
Can you make molecule CCOC(=O)c1c(NC(=O)C2CCCC2)sc(C)c1C less soluble in water and more hydrogen bond donors? The output molecule should be similar to the input molecule. | CCOC(=O)c1c(NC(=O)C2CCCC2)sc(C)c1C | CCOC(=O)c1c(NC(=O)NNc2ccccc2C2CCCC2)sc(C)c1C | 204 | replace | true |
Can you make molecule O=C1CCCN1c1ccc(S(=O)(=O)NCC[C@H]2CCCO2)cc1 less soluble in water? The output molecule should be similar to the input molecule. | O=C1CCCN1c1ccc(S(=O)(=O)NCC[C@H]2CCCO2)cc1 | C[C@@](C#N)(CCN1CCCC1=O)c1ccc(S(=O)(=O)NCC[C@H]2CCCO2)cc1 | 102 | insert | true |
Can you make molecule C[C@@H](N[C@@H](c1ccccc1)c1ccco1)c1c(F)cccc1F more soluble in water and more hydrogen bond acceptors? The output molecule should be similar to the input molecule. | C[C@@H](N[C@@H](c1ccccc1)c1ccco1)c1c(F)cccc1F | C[C@@H](N[C@@H](c1ccccc1)c1ccco1)C(=O)NOc1c(F)cccc1F | 201 | replace | true |
Can you make molecule C[C@H]1CCCC[C@H]1NC(=O)NC(=O)COC(=O)c1cccc(Br)c1 less soluble in water and more hydrogen bond acceptors? The output molecule should be similar to the input molecule. | C[C@H]1CCCC[C@H]1NC(=O)NC(=O)COC(=O)c1cccc(Br)c1 | Cc1cc(N[C@@H]2CCCC[C@@H]2C)cc(=O)n1NC(=O)COC(=O)c1cccc(Br)c1 | 202 | replace | true |
Can you make molecule c1ccc2c(c1)CCN(Cc1ccon1)CC2 more soluble in water? The output molecule should be similar to the input molecule. | c1ccc2c(c1)CCN(Cc1ccon1)CC2 | Nn1c(Cc2ccon2)nnc(N2CCc3ccccc3CC2)c1=O | 101 | insert | true |
Can you make molecule Cc1nc([C@H]2CCC[NH2+]2)cc(N2CCCC2)n1 lower permeability? The output molecule should be similar to the input molecule. | Cc1nc([C@H]2CCC[NH2+]2)cc(N2CCCC2)n1 | Cc1nc(C(=O)NO[C@H]2CCC[NH2+]2)cc(N2CCCC2)n1 | 106 | insert | true |
Can you make molecule CCc1nn(C)cc1NC(=O)C(=O)N[C@H]1C[C@@H](C)N(c2ccccc2)C1=O less soluble in water and more hydrogen bond acceptors? The output molecule should be similar to the input molecule. | CCc1nn(C)cc1NC(=O)C(=O)N[C@H]1C[C@@H](C)N(c2ccccc2)C1=O | CCc1nn(C)cc1Nc1ccc2ncc(C(=O)C(=O)N[C@H]3C[C@@H](C)N(c4ccccc4)C3=O)c(=O)n2n1 | 202 | insert | true |
Can you make molecule COc1ccccc1Nc1cc(OC)c([N+](=O)[O-])nc1[N+](=O)[O-] higher permeability? The output molecule should be similar to the input molecule. | COc1ccccc1Nc1cc(OC)c([N+](=O)[O-])nc1[N+](=O)[O-] | COc1ccccc1-c1ccc(-c2cc(OC)c([N+](=O)[O-])nc2[N+](=O)[O-])s1 | 105 | replace | true |
Can you make molecule C[NH+](C)[C@@H]1CC[C@@H](NC(=O)NCC(=O)OCc2ccccc2Cl)C1 more soluble in water and higher permeability? The output molecule should be similar to the input molecule. | C[NH+](C)[C@@H]1CC[C@@H](NC(=O)NCC(=O)OCc2ccccc2Cl)C1 | C[NH+](C)[C@@H]1CC[C@@H](NCC2=CCC[NH+](NCC(=O)OCc3ccccc3Cl)C2)C1 | 205 | replace | true |
Can you make molecule C[C@@H]1C[C@H](C)CN(c2oc(Cc3ccccc3)nc2C#N)C1 more soluble in water and more hydrogen bond donors? The output molecule should be similar to the input molecule. | C[C@@H]1C[C@H](C)CN(c2oc(Cc3ccccc3)nc2C#N)C1 | C[C@@H]1C[C@H](C)CN(c2oc(Cc3ccc(O)cc3O)nc2C#N)C1 | 203 | replace | true |
Can you make molecule CC(C)[NH+]1CCC[C@H](C(=O)NCc2nnnn2-c2ccccc2)C1 more like a drug? The output molecule should be similar to the input molecule. | CC(C)[NH+]1CCC[C@H](C(=O)NCc2nnnn2-c2ccccc2)C1 | CC(C)[C@@H]1CN(C(=O)NCc2nnnn2-c2ccccc2)C[C@H]1C | 103 | replace | true |
Can you make molecule COc1ccc(C(=O)O/N=C2/C(=O)N(C)c3ccccc32)cc1OC more soluble in water and more hydrogen bond donors? The output molecule should be similar to the input molecule. | COc1ccc(C(=O)O/N=C2/C(=O)N(C)c3ccccc32)cc1OC | COc1cc(C(=O)O/N=C2/C(=O)N(C)c3ccccc32)ccc1-c1[nH+]c(OC)n(N)c1N | 203 | insert | true |
Can you make molecule Cc1nn(C)c2nc(C3CCN(C(=O)c4ccccc4Cn4cc[nH+]c4C)CC3)ccc12 more soluble in water? The output molecule should be similar to the input molecule. | Cc1nn(C)c2nc(C3CCN(C(=O)c4ccccc4Cn4cc[nH+]c4C)CC3)ccc12 | Cc1nn(C)c2nc(C3CCN(C(=O)c4ccccc4Cn4nc([O-])ccc4=O)CC3)ccc12 | 101 | replace | true |
Can you make molecule C[C@@H](NC(=O)CCNS(=O)(=O)c1ccc(F)cc1)c1cccc2ccccc12 more soluble in water? The output molecule should be similar to the input molecule. | C[C@@H](NC(=O)CCNS(=O)(=O)c1ccc(F)cc1)c1cccc2ccccc12 | C[C@@H](NC(=O)CCNS(=O)(=O)c1ccc(F)cc1)C(=O)NOc1cccc2ccccc12 | 101 | replace | true |
Can you make molecule Cc1ccc(C(=O)N2CCc3cc(F)ccc3[C@@H]2C)cc1S(N)(=O)=O lower permeability? The output molecule should be similar to the input molecule. | Cc1ccc(C(=O)N2CCc3cc(F)ccc3[C@@H]2C)cc1S(N)(=O)=O | Cc1ccc(-c2nnc(C(=O)N3CCc4cc(F)ccc4[C@@H]3C)n(N)c2=O)cc1S(N)(=O)=O | 106 | insert | true |
Can you make molecule CC(C)(C)OC(=O)N1[C@@H](C(=O)NC[C@@H]2CCC[C@@H]2O)C[C@@H]2CCCC[C@H]21 less soluble in water and more hydrogen bond acceptors? The output molecule should be similar to the input molecule. | CC(C)(C)OC(=O)N1[C@@H](C(=O)NC[C@@H]2CCC[C@@H]2O)C[C@@H]2CCCC[C@H]21 | Cc1nc([C@H]2C[C@@H]3CCCC[C@H]3N2C(=O)OC(C)(C)C)cn1C(=O)NC[C@@H]1CCC[C@@H]1O | 202 | insert | true |
Can you make molecule N#C[C@H]1CN(Cc2n[nH]c(=O)[nH]2)CCO1 less soluble in water and more hydrogen bond donors? The output molecule should be similar to the input molecule. | N#C[C@H]1CN(Cc2n[nH]c(=O)[nH]2)CCO1 | N/C(CCCCCc1n[nH]c(=O)[nH]1)=N/O | 204 | replace | true |
Can you make molecule CC(C)C(=O)c1nc2ccccc2s1 more soluble in water and lower permeability? The output molecule should be similar to the input molecule. | CC(C)C(=O)c1nc2ccccc2s1 | CC(C)=NNC(=O)c1nc2ccccc2s1 | 206 | replace | true |
Can you make molecule CCC[C@@](C)(Nc1ccc(Cl)c(Br)c1)C(=O)OC with more hydrogen bond acceptors? The output molecule should be similar to the input molecule. | CCC[C@@](C)(Nc1ccc(Cl)c(Br)c1)C(=O)OC | CCC[C@](C)(C(=O)OC)n1cc(N)c(-c2ccc(Cl)c(Br)c2)n1 | 107 | replace | true |
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