id stringlengths 36 36 | task stringclasses 3
values | question stringlengths 104 613 | src_smiles stringlengths 8 519 | ref_smiles stringlengths 8 515 | add_group stringclasses 9
values | remove_group stringclasses 10
values |
|---|---|---|---|---|---|---|
babeb1cb-b2b3-488a-bd5c-886ad4bbcb56 | add | Modify the molecule CCc1ccc(C2CCCN2S(=O)(=O)N2CCC(COC)C2)o1 by adding a carboxyl.
Please wrap the final SMILES in <smiles>...</smiles>. | CCc1ccc(C2CCCN2S(=O)(=O)N2CCC(COC)C2)o1 | COCC1CCN(S(=O)(=O)N2CCCC2c2ccc(C(C)C(=O)O)o2)C1 | carboxyl | null |
101c2251-aa0b-42c8-8397-7d71574b6c67 | add | Please add a amine to the molecule CS(=O)(=O)c1ccnc2c1c(Sc1cnsc1)c1n2CCCC1CC(=O)[O-].
Please wrap the final SMILES in <smiles>...</smiles>. | CS(=O)(=O)c1ccnc2c1c(Sc1cnsc1)c1n2CCCC1CC(=O)[O-]. | NCS(=O)(=O)c1ccnc2c1c(Sc1cnsc1)c1n2CCCC1CC(=O)[O-]. | amine | null |
ee8299dc-5f07-458c-8e3c-cf371a517adf | add | Please add a nitrile to the molecule Cc1c(C(F)(F)F)[nH]c2c(C)ccc(Br)c2c1=O.
Please wrap the final SMILES in <smiles>...</smiles>. | Cc1c(C(F)(F)F)[nH]c2c(C)ccc(Br)c2c1=O. | Cc1c(C(F)(F)F)[nH]c2c(C)c(C#N)cc(Br)c2c1=O | nitrile | null |
3e7a2c2b-efdb-4d8d-8e40-c6caba7e5d34 | add | Modify the molecule CCCOc1cccc(N)n1 by adding a benzene ring.
Please wrap the final SMILES in <smiles>...</smiles>. | CCCOc1cccc(N)n1 | Nc1cccc(OCCCc2ccccc2)n1 | benzene | null |
acc31a73-b194-4878-9ffd-d42d402456b9 | add | Modify the molecule Cc1ccc(C(=O)N2CCCC2)cc1NC(=O)C1CC[NH+](C(C)C(=O)Nc2ccc(Cl)c(C(=O)N3CCCC3)c2)CC1 by adding a hydroxyl.
Please wrap the final SMILES in <smiles>...</smiles>. | Cc1ccc(C(=O)N2CCCC2)cc1NC(=O)C1CC[NH+](C(C)C(=O)Nc2ccc(Cl)c(C(=O)N3CCCC3)c2)CC1 | Cc1ccc(C(=O)N2CCCC2)cc1NC(=O)C1(O)CC[NH+](C(C)C(=O)Nc2ccc(Cl)c(C(=O)N3CCCC3)c2)CC1 | hydroxyl | null |
506f7bd5-3fe5-4611-b273-dce449c9481d | add | Please add a hydroxyl to the molecule CCC(NC(=O)c1cc(F)c(N)c(F)c1)C1CCCCC1.
Please wrap the final SMILES in <smiles>...</smiles>. | CCC(NC(=O)c1cc(F)c(N)c(F)c1)C1CCCCC1. | CCC(NC(=O)c1cc(F)c(N)c(F)c1O)C1CCCCC1 | hydroxyl | null |
30b68808-0e38-4102-b7d7-bde86a11c7f8 | add | Modify the molecule CC1CCCC(C)[NH+]1CCCC(N)=O by adding a amine.
Please wrap the final SMILES in <smiles>...</smiles>. | CC1CCCC(C)[NH+]1CCCC(N)=O | CC1CCC(N)C(C)[NH+]1CCCC(N)=O | amine | null |
b89580a0-afbb-4a56-aefc-632de7d8d714 | add | Modify the molecule C=C(COC1CCCC(OCc2nc(-c3cccc(C)c3)oc2C)C1)C(=O)OCC by adding a benzene ring.
Please wrap the final SMILES in <smiles>...</smiles>. | C=C(COC1CCCC(OCc2nc(-c3cccc(C)c3)oc2C)C1)C(=O)OCC | C=C(COC1CCCC(OCc2nc(-c3cccc(C)c3)oc2Cc2ccccc2)C1)C(=O)OCC | benzene | null |
df4286e6-6f50-4600-8318-5b903b000bd4 | add | Modify the molecule CC(C)c1ccc(C(=O)N(C)C2CCC[NH2+]CC2)cc1 by adding a nitrile.
Please wrap the final SMILES in <smiles>...</smiles>. | CC(C)c1ccc(C(=O)N(C)C2CCC[NH2+]CC2)cc1 | CN(C(=O)c1ccc(C(C)(C)C#N)cc1)C1CCC[NH2+]CC1 | nitrile | null |
e7476004-b04f-429a-ab78-936a235c9f76 | add | Modify the molecule [NH3+]CCCCC(O)C([NH3+])CCO by adding a benzene ring.
Please wrap the final SMILES in <smiles>...</smiles>. | [NH3+]CCCCC(O)C([NH3+])CCO | [NH3+]C(CCCC(O)C([NH3+])CCO)c1ccccc1 | benzene | null |
f2750598-6baa-40e6-93b9-29ec533f5635 | add | Modify the molecule CCOC(=O)N(CC[NH3+])C(=S)NCCCc1ccccc1 by adding a benzene ring.
Please wrap the final SMILES in <smiles>...</smiles>. | CCOC(=O)N(CC[NH3+])C(=S)NCCCc1ccccc1 | CCOC(=O)N(CC[NH3+])C(=S)NCCC(c1ccccc1)c1ccccc1 | benzene | null |
b6c6267c-a3bb-489f-9dd0-0706eae446ef | add | Modify the molecule COC([Si])(CCCC1CC2C=CC1C2)OC by adding a benzene ring.
Please wrap the final SMILES in <smiles>...</smiles>. | COC([Si])(CCCC1CC2C=CC1C2)OC | COC([Si])(CCCC1CC2C=CC1(c1ccccc1)C2)OC | benzene | null |
280e395d-6a9b-4890-89cb-c6f21abdb09b | add | Please add a hydroxyl to the molecule CCC(C)COC(=O)OC(C)C(C)OC(=O)C([NH3+])Cc1ccc(OC(=O)C(C)C(C)C)c(OC(=O)C(C)C(C)C)c1.
Please wrap the final SMILES in <smiles>...</smiles>. | CCC(C)COC(=O)OC(C)C(C)OC(=O)C([NH3+])Cc1ccc(OC(=O)C(C)C(C)C)c(OC(=O)C(C)C(C)C)c1. | CCC(C)COC(=O)OC(C)C(C)OC(=O)C([NH3+])C(O)c1ccc(OC(=O)C(C)C(C)C)c(OC(=O)C(C)C(C)C)c1 | hydroxyl | null |
0aa7286c-1305-4dc8-9d76-3e6a314b84d8 | add | Please add a benzene ring to the molecule CCNC(=NCC(C)(C)[NH+]1CCCCC1)NC1CCN(c2cccs2)CC1.
Please wrap the final SMILES in <smiles>...</smiles>. | CCNC(=NCC(C)(C)[NH+]1CCCCC1)NC1CCN(c2cccs2)CC1. | CCNC(=NCC(C)(C)[NH+]1CCCCC1c1ccccc1)NC1CCN(c2cccs2)CC1 | benzene | null |
91f57e8d-1602-44b2-8276-bf78f2dd94c8 | add | Please add a benzene ring to the molecule CCCn1c(=O)c2[nH]c(-c3ccc(N(CC4CC4)C(=O)c4ccc(I)nc4)nc3)cc2n(CCC)c1=O.
Please wrap the final SMILES in <smiles>...</smiles>. | CCCn1c(=O)c2[nH]c(-c3ccc(N(CC4CC4)C(=O)c4ccc(I)nc4)nc3)cc2n(CCC)c1=O. | CCCn1c(=O)c2[nH]c(-c3ccc(N(C(=O)c4ccc(I)nc4)C(c4ccccc4)C4CC4)nc3)cc2n(CCC)c1=O | benzene | null |
ec7666d0-f129-420d-b762-f76616dd0cfa | add | Please add a benzene ring to the molecule Cc1ccc(S(=O)(=O)N(CC(=O)Nc2ccccc2N)c2cccc([N+](=O)[O-])c2)cc1.
Please wrap the final SMILES in <smiles>...</smiles>. | Cc1ccc(S(=O)(=O)N(CC(=O)Nc2ccccc2N)c2cccc([N+](=O)[O-])c2)cc1. | Cc1ccc(S(=O)(=O)N(CC(=O)Nc2ccccc2N)c2cccc([N+](=O)[O-])c2)cc1-c1ccccc1 | benzene | null |
3a4f4788-c293-4bfc-aa81-02544b6cc74b | add | Modify the molecule Cc1cc(C)c(-c2csc(NC(=O)Cc3ccc(F)cc3)n2)c(C)c1 by adding a amine.
Please wrap the final SMILES in <smiles>...</smiles>. | Cc1cc(C)c(-c2csc(NC(=O)Cc3ccc(F)cc3)n2)c(C)c1 | Cc1cc(CN)cc(C)c1-c1csc(NC(=O)Cc2ccc(F)cc2)n1 | amine | null |
97fa82a9-4d05-4e02-a493-16e8a7e423c8 | add | Please add a hydroxyl to the molecule CCCCn1nc(C(=O)Nc2ccc(OCC#N)cc2)c2ccccc2c1=O.
Please wrap the final SMILES in <smiles>...</smiles>. | CCCCn1nc(C(=O)Nc2ccc(OCC#N)cc2)c2ccccc2c1=O. | CCCCn1nc(C(=O)Nc2ccc(OCC#N)cc2)c2cccc(O)c2c1=O | hydroxyl | null |
436f2d95-2a94-451a-b8d8-ffa294206501 | add | Please add a hydroxyl to the molecule O=C1CC(Nc2cc(F)ccc2[N+](=O)[O-])CN1.
Please wrap the final SMILES in <smiles>...</smiles>. | O=C1CC(Nc2cc(F)ccc2[N+](=O)[O-])CN1. | O=C1CC(O)(Nc2cc(F)ccc2[N+](=O)[O-])CN1 | hydroxyl | null |
310728f2-b304-4476-8337-cc5070ae2022 | add | Modify the molecule C1C[NH+](Cc2nnnn2C2CC2)CC2(CC2)CO1 by adding a hydroxyl.
Please wrap the final SMILES in <smiles>...</smiles>. | C1C[NH+](Cc2nnnn2C2CC2)CC2(CC2)CO1 | OC1CC12COCC[NH+](Cc1nnnn1C1CC1)C2 | hydroxyl | null |
4b2cc8b6-50fb-4ae2-a004-ce407977904d | add | Please add a hydroxyl to the molecule CC(C)C(C)n1cncc1C[NH3+].
Please wrap the final SMILES in <smiles>...</smiles>. | CC(C)C(C)n1cncc1C[NH3+]. | CC(CO)C(C)n1cncc1C[NH3+] | hydroxyl | null |
e6e29340-a834-4d26-9017-50b70bb5e677 | add | Modify the molecule CCCOc1cccc(C([NH3+])C(=O)NCCCO)c1 by adding a benzene ring.
Please wrap the final SMILES in <smiles>...</smiles>. | CCCOc1cccc(C([NH3+])C(=O)NCCCO)c1 | CCCOc1cc(-c2ccccc2)cc(C([NH3+])C(=O)NCCCO)c1 | benzene | null |
10acc4b2-d5f3-4584-bcb3-f55686a36f83 | add | Modify the molecule CCOc1ccc(C([O-])=C2C(=O)C(=O)N(c3ccccc3OC)C2c2ccc(O)cc2)cc1C(C)(C)C by adding a benzene ring.
Please wrap the final SMILES in <smiles>...</smiles>. | CCOc1ccc(C([O-])=C2C(=O)C(=O)N(c3ccccc3OC)C2c2ccc(O)cc2)cc1C(C)(C)C | CCOc1ccc(C([O-])=C2C(=O)C(=O)N(c3ccccc3OC)C2c2ccc(O)cc2)c(-c2ccccc2)c1C(C)(C)C | benzene | null |
a80ef6cb-f223-41c1-b785-5f7e3b4273db | add | Modify the molecule Cc1ccc(Cl)c(OCn2ccc(C(=O)N3CC[NH+](Cc4cnn(C)c4)CC3)n2)c1 by adding a carboxyl.
Please wrap the final SMILES in <smiles>...</smiles>. | Cc1ccc(Cl)c(OCn2ccc(C(=O)N3CC[NH+](Cc4cnn(C)c4)CC3)n2)c1 | Cc1ccc(Cl)c(OCn2cc(C(=O)O)c(C(=O)N3CC[NH+](Cc4cnn(C)c4)CC3)n2)c1 | carboxyl | null |
be8f5383-a521-4984-9771-e48bdd48c062 | add | Please add a benzene ring to the molecule CCCCCCCCCCOc1ccc(-c2ccc(OC(=O)c3c(F)c(F)c(F)c(F)c3F)cc2)cc1.
Please wrap the final SMILES in <smiles>...</smiles>. | CCCCCCCCCCOc1ccc(-c2ccc(OC(=O)c3c(F)c(F)c(F)c(F)c3F)cc2)cc1. | CCCCCCCCCCOc1ccc(-c2ccc(OC(=O)c3c(F)c(F)c(F)c(F)c3F)cc2-c2ccccc2)cc1 | benzene | null |
3c84f922-9754-4858-a6ee-31954e4407d5 | add | Please add a hydroxyl to the molecule O=C(NC1CC1)c1ccc(C#CCO)c(F)c1.
Please wrap the final SMILES in <smiles>...</smiles>. | O=C(NC1CC1)c1ccc(C#CCO)c(F)c1. | O=C(NC1CC1)c1cc(F)c(C#CCO)cc1O | hydroxyl | null |
1df50a76-c4a9-40d8-8463-969e4c332b24 | add | Modify the molecule CCOc1cc(C=NNc2nc(C)cc(C)n2)ccc1OCC(=O)Nc1ccccc1 by adding a carboxyl.
Please wrap the final SMILES in <smiles>...</smiles>. | CCOc1cc(C=NNc2nc(C)cc(C)n2)ccc1OCC(=O)Nc1ccccc1 | Cc1cc(C)nc(NN=Cc2ccc(OCC(=O)Nc3ccccc3)c(OC(C)C(=O)O)c2)n1 | carboxyl | null |
8acd0bf3-694a-4330-9292-c8eac2dc852b | add | Modify the molecule COC(=O)CCc1ccc(OCc2ccc(Oc3ccc(Oc4ccccc4)cc3)cc2)cc1 by adding a benzene ring.
Please wrap the final SMILES in <smiles>...</smiles>. | COC(=O)CCc1ccc(OCc2ccc(Oc3ccc(Oc4ccccc4)cc3)cc2)cc1 | COC(=O)CCc1ccc(OCc2ccc(Oc3ccc(Oc4ccccc4)cc3)cc2-c2ccccc2)cc1 | benzene | null |
87dbc507-09a8-45a4-8bca-fa65cc7a5638 | add | Please add a benzene ring to the molecule COC(=O)c1ccnc(C(F)(F)F)c1-c1ccc(OC(F)(F)F)cc1.
Please wrap the final SMILES in <smiles>...</smiles>. | COC(=O)c1ccnc(C(F)(F)F)c1-c1ccc(OC(F)(F)F)cc1. | COC(=O)c1c(-c2ccccc2)cnc(C(F)(F)F)c1-c1ccc(OC(F)(F)F)cc1 | benzene | null |
f546aff5-be06-49a6-80d2-c060b8d01482 | add | Please add a benzene ring to the molecule O=C(NC(c1ccccc1)c1ccccc1)C1CC[NH+](Cc2ccc3ccccc3c2)CC1.
Please wrap the final SMILES in <smiles>...</smiles>. | O=C(NC(c1ccccc1)c1ccccc1)C1CC[NH+](Cc2ccc3ccccc3c2)CC1. | O=C(NC(c1ccccc1)c1ccccc1)C1CC[NH+](Cc2cc(-c3ccccc3)c3ccccc3c2)CC1 | benzene | null |
e1081218-46ca-4c27-8401-85f211be2192 | add | Please add a hydroxyl to the molecule CC(C)Nc1cc[nH+]c(C(=O)Nc2c(Cl)cccc2Cl)c1.
Please wrap the final SMILES in <smiles>...</smiles>. | CC(C)Nc1cc[nH+]c(C(=O)Nc2c(Cl)cccc2Cl)c1. | CC(CO)Nc1cc[nH+]c(C(=O)Nc2c(Cl)cccc2Cl)c1 | hydroxyl | null |
86223763-69b3-4136-a69a-bf59c1d6ff5f | add | Modify the molecule C=CCN1C(=O)C(CC(=O)c2ccc(Br)cc2)SC1=[NH+]c1ccc(F)cc1 by adding a benzene ring.
Please wrap the final SMILES in <smiles>...</smiles>. | C=CCN1C(=O)C(CC(=O)c2ccc(Br)cc2)SC1=[NH+]c1ccc(F)cc1 | C=CCN1C(=O)C(CC(=O)c2ccc(Br)cc2-c2ccccc2)SC1=[NH+]c1ccc(F)cc1 | benzene | null |
f1ef4db3-1169-440e-b29b-af06aea6fb1e | add | Modify the molecule Cc1cccc(NS(=O)(=O)c2cccc(C(=O)OCC(N)=O)c2)c1 by adding a benzene ring.
Please wrap the final SMILES in <smiles>...</smiles>. | Cc1cccc(NS(=O)(=O)c2cccc(C(=O)OCC(N)=O)c2)c1 | Cc1cccc(NS(=O)(=O)c2cccc(C(=O)OCC(N)=O)c2-c2ccccc2)c1 | benzene | null |
aaf5a357-5eeb-41bf-bfd1-00a6ca63affa | add | Modify the molecule O=C([O-])c1ccc(CC(=CCc2ccc(O)cc2)c2ccccc2)cc1 by adding a hydroxyl.
Please wrap the final SMILES in <smiles>...</smiles>. | O=C([O-])c1ccc(CC(=CCc2ccc(O)cc2)c2ccccc2)cc1 | O=C([O-])c1ccc(CC(=CCc2ccc(O)cc2)c2ccc(O)cc2)cc1 | hydroxyl | null |
78969a2f-d943-43d3-a75c-29150fd5a719 | add | Modify the molecule Cc1cc(F)cc(NS(=O)(=O)c2ccc(Cl)c(C[NH3+])c2)c1 by adding a amine.
Please wrap the final SMILES in <smiles>...</smiles>. | Cc1cc(F)cc(NS(=O)(=O)c2ccc(Cl)c(C[NH3+])c2)c1 | Cc1cc(F)c(N)c(NS(=O)(=O)c2ccc(Cl)c(C[NH3+])c2)c1 | amine | null |
b34312ef-e7ab-4d53-91b7-8bbd120060ae | add | Please add a hydroxyl to the molecule C[NH2+]C(Cc1ccc(F)c(Br)c1)C1CCc2ccccc21.
Please wrap the final SMILES in <smiles>...</smiles>. | C[NH2+]C(Cc1ccc(F)c(Br)c1)C1CCc2ccccc21. | C[NH2+]C(Cc1cc(Br)c(F)cc1O)C1CCc2ccccc21 | hydroxyl | null |
04459a49-140b-4dc3-9e8f-47aee0596eb1 | add | Please add a hydroxyl to the molecule O=C(NCC1CC1)C1CCCN(C(=O)C2(O)CCCC2)C1.
Please wrap the final SMILES in <smiles>...</smiles>. | O=C(NCC1CC1)C1CCCN(C(=O)C2(O)CCCC2)C1. | O=C(NCC1CC1)C1CCCN(C(=O)C2(O)CCC(O)C2)C1 | hydroxyl | null |
84bef176-d317-44e1-b451-06fcaf4bd369 | add | Modify the molecule O=C1C(=Cc2c(N3CCC4(CC3)OCCO4)nc3ccccn3c2=O)SC(=S)N1Cc1ccc(F)cc1 by adding a amine.
Please wrap the final SMILES in <smiles>...</smiles>. | O=C1C(=Cc2c(N3CCC4(CC3)OCCO4)nc3ccccn3c2=O)SC(=S)N1Cc1ccc(F)cc1 | NC1COC2(CCN(c3nc4ccccn4c(=O)c3C=C3SC(=S)N(Cc4ccc(F)cc4)C3=O)CC2)O1 | amine | null |
45ea7140-528e-4416-b0db-62c22cb36da5 | add | Please add a benzene ring to the molecule CC(C)n1c(=O)c2nscc2n(CC(=O)Nc2ccc(F)c(Cl)c2)c1=O.
Please wrap the final SMILES in <smiles>...</smiles>. | CC(C)n1c(=O)c2nscc2n(CC(=O)Nc2ccc(F)c(Cl)c2)c1=O. | CC(Cc1ccccc1)n1c(=O)c2nscc2n(CC(=O)Nc2ccc(F)c(Cl)c2)c1=O | benzene | null |
5fc1da76-13b9-41c9-b464-62862bafac58 | add | Please add a hydroxyl to the molecule C=CCC1CCCC(CC(CCC)OCc2ccccc2)N1C(=O)OC.
Please wrap the final SMILES in <smiles>...</smiles>. | C=CCC1CCCC(CC(CCC)OCc2ccccc2)N1C(=O)OC. | C=CCC1CCCC(CC(CCCO)OCc2ccccc2)N1C(=O)OC | hydroxyl | null |
d2b03128-3ad7-49f3-8b63-e78f8a68aefb | add | Modify the molecule Cc1cccc(C)c1-n1nnnc1SCC(=O)NCC(C)(C)[NH+]1CCOCC1 by adding a amine.
Please wrap the final SMILES in <smiles>...</smiles>. | Cc1cccc(C)c1-n1nnnc1SCC(=O)NCC(C)(C)[NH+]1CCOCC1 | Cc1cccc(C)c1-n1nnnc1SCC(=O)NCC(C)(C)[NH+]1CCOC(N)C1 | amine | null |
5c7b0ab6-343f-4473-beb0-c87310a3e307 | add | Please add a thiol to the molecule CC(=O)N1CCc2cc(C(=O)NCCCc3nn(-c4ccc(F)cc4)c(N)c3C#N)ccc21.
Please wrap the final SMILES in <smiles>...</smiles>. | CC(=O)N1CCc2cc(C(=O)NCCCc3nn(-c4ccc(F)cc4)c(N)c3C#N)ccc21. | CC(=O)N1CCc2cc(C(=O)NCCCc3nn(-c4ccc(F)cc4)c(N)c3C#N)c(S)cc21 | thiol | null |
9af76d1e-e760-4e94-8e24-9b469d78c131 | add | Modify the molecule Cc1c(SCCCSc2n[nH]c(N)n2)ccnc1CSc1nc2ccccc2[nH]1 by adding a carboxyl.
Please wrap the final SMILES in <smiles>...</smiles>. | Cc1c(SCCCSc2n[nH]c(N)n2)ccnc1CSc1nc2ccccc2[nH]1 | Cc1c(SCC(CSc2n[nH]c(N)n2)C(=O)O)ccnc1CSc1nc2ccccc2[nH]1 | carboxyl | null |
17b17de4-e105-4b97-9062-a8698ede2690 | add | Modify the molecule CCN(CC)C(=O)CCNC(=O)NC(CCOC)C(=O)[O-] by adding a hydroxyl.
Please wrap the final SMILES in <smiles>...</smiles>. | CCN(CC)C(=O)CCNC(=O)NC(CCOC)C(=O)[O-] | CCN(CC)C(=O)CCNC(=O)NC(O)(CCOC)C(=O)[O-] | hydroxyl | null |
13459839-dc9c-408a-b6a5-fbacca8fa9e6 | add | Modify the molecule Cc1cnc(Nc2nc(C(F)(F)F)ccc2C(N)=O)s1 by adding a hydroxyl.
Please wrap the final SMILES in <smiles>...</smiles>. | Cc1cnc(Nc2nc(C(F)(F)F)ccc2C(N)=O)s1 | NC(=O)c1ccc(C(F)(F)F)nc1Nc1ncc(CO)s1 | hydroxyl | null |
1c228b59-7203-4bfa-a3d4-6e95e1e93a1b | add | Please add a benzene ring to the molecule O=C(Cc1ccc2ccccc2c1)Nc1nc2c(nc1-c1cccs1)-c1ccc(O)cc1CC2.
Please wrap the final SMILES in <smiles>...</smiles>. | O=C(Cc1ccc2ccccc2c1)Nc1nc2c(nc1-c1cccs1)-c1ccc(O)cc1CC2. | O=C(Cc1ccc2cc(-c3ccccc3)ccc2c1)Nc1nc2c(nc1-c1cccs1)-c1ccc(O)cc1CC2 | benzene | null |
66d8cbb8-7fcd-49fc-a0d3-e198e44ed355 | add | Please add a benzene ring to the molecule CC(=O)N1C=Cc2ccccc2C1CC(=O)Nc1cccc(S(=O)(=O)N2CCCCCC2)c1.
Please wrap the final SMILES in <smiles>...</smiles>. | CC(=O)N1C=Cc2ccccc2C1CC(=O)Nc1cccc(S(=O)(=O)N2CCCCCC2)c1. | CC(=O)N1C=Cc2ccccc2C1CC(=O)Nc1cccc(S(=O)(=O)N2CCCCC(c3ccccc3)C2)c1 | benzene | null |
174e5875-87c8-4fbe-8b12-43c6ca350b2e | add | Please add a benzene ring to the molecule C[NH+]=C(NCCCCOCCc1ccccc1)NC1CC[NH+](Cc2ccccc2)C(C)C1.
Please wrap the final SMILES in <smiles>...</smiles>. | C[NH+]=C(NCCCCOCCc1ccccc1)NC1CC[NH+](Cc2ccccc2)C(C)C1. | C[NH+]=C(NCCC(COCCc1ccccc1)c1ccccc1)NC1CC[NH+](Cc2ccccc2)C(C)C1 | benzene | null |
a6d54606-fc0c-434e-97fb-c04d3e3a0f89 | add | Please add a aldehyde to the molecule CCCCC(O)Cn1cc2c(n1)CCc1c-2sc2ncnc(Nc3ccc(OCc4cccc(F)c4)c(Cl)c3)c12.
Please wrap the final SMILES in <smiles>...</smiles>. | CCCCC(O)Cn1cc2c(n1)CCc1c-2sc2ncnc(Nc3ccc(OCc4cccc(F)c4)c(Cl)c3)c12. | CCCCC(O)Cn1nc2c(c1CC=O)-c1sc3ncnc(Nc4ccc(OCc5cccc(F)c5)c(Cl)c4)c3c1CC2 | aldehyde | null |
44c9e9be-3851-4f70-a321-dfa041d48d57 | add | Modify the molecule CC(C)NC(=O)c1csc(-c2ccccn2)n1 by adding a amine.
Please wrap the final SMILES in <smiles>...</smiles>. | CC(C)NC(=O)c1csc(-c2ccccn2)n1 | CC(CN)NC(=O)c1csc(-c2ccccn2)n1 | amine | null |
8af1a686-55ff-48b6-9ed3-8e925c885e22 | add | Please add a benzene ring to the molecule Cc1nn(C)c(NCc2cccc(OC3CCCCC3)c2)c1[N+](=O)[O-].
Please wrap the final SMILES in <smiles>...</smiles>. | Cc1nn(C)c(NCc2cccc(OC3CCCCC3)c2)c1[N+](=O)[O-]. | Cc1nn(C)c(NCc2cccc(OC3CCCC(c4ccccc4)C3)c2)c1[N+](=O)[O-] | benzene | null |
3cad382c-df19-4d34-9a63-73e94277069b | add | Modify the molecule Cc1ccc(S(=O)(=O)Nc2ccc(Nc3cc(C)on3)cc2)c(C)c1 by adding a benzene ring.
Please wrap the final SMILES in <smiles>...</smiles>. | Cc1ccc(S(=O)(=O)Nc2ccc(Nc3cc(C)on3)cc2)c(C)c1 | Cc1ccc(S(=O)(=O)Nc2ccc(Nc3cc(C)on3)c(-c3ccccc3)c2)c(C)c1 | benzene | null |
4e915716-db32-41a6-a81d-b43aee960545 | add | Modify the molecule COCCCC(NC(=O)NCC(C)COC)C(=O)[O-] by adding a hydroxyl.
Please wrap the final SMILES in <smiles>...</smiles>. | COCCCC(NC(=O)NCC(C)COC)C(=O)[O-] | COCC(C)CNC(=O)NC(CCC(O)OC)C(=O)[O-] | hydroxyl | null |
2e2af484-e22b-4485-b892-a553ec7c36f5 | add | Please add a hydroxyl to the molecule Cc1ccc(S(=O)(=O)N(CC(=O)Nc2ccc(C)c(Cl)c2)c2cccc(Cl)c2)cc1.
Please wrap the final SMILES in <smiles>...</smiles>. | Cc1ccc(S(=O)(=O)N(CC(=O)Nc2ccc(C)c(Cl)c2)c2cccc(Cl)c2)cc1. | Cc1ccc(S(=O)(=O)N(c2cccc(Cl)c2)C(O)C(=O)Nc2ccc(C)c(Cl)c2)cc1 | hydroxyl | null |
1afa3378-22b8-4cd6-9261-4b92e87482fd | add | Please add a benzene ring to the molecule O=c1c2ccccc2nc(SCc2c(F)cccc2F)n1CCc1ccccc1.
Please wrap the final SMILES in <smiles>...</smiles>. | O=c1c2ccccc2nc(SCc2c(F)cccc2F)n1CCc1ccccc1. | O=c1c2ccccc2nc(SCc2c(F)cccc2F)n1CCc1cccc(-c2ccccc2)c1 | benzene | null |
116e6d72-2469-4c18-9388-69e07e7fd7fa | add | Please add a hydroxyl to the molecule CC(C)(C)C=CC1(OCC(=O)[O-])C(C2COC(C)(C)O2)OC2OC(C)(C)OC21.
Please wrap the final SMILES in <smiles>...</smiles>. | CC(C)(C)C=CC1(OCC(=O)[O-])C(C2COC(C)(C)O2)OC2OC(C)(C)OC21. | CC(C)(C)C=CC1(OCC(=O)[O-])C2OC(C)(C)OC2OC1C1OC(C)(C)OC1O | hydroxyl | null |
d8fa23b7-ce3c-4dc9-8cdb-3dac36ccd75b | add | Modify the molecule CCCCCN(c1ncc(N)cn1)C(C)C by adding a benzene ring.
Please wrap the final SMILES in <smiles>...</smiles>. | CCCCCN(c1ncc(N)cn1)C(C)C | CCCCCN(c1ncc(N)cn1)C(C)Cc1ccccc1 | benzene | null |
223945db-ce29-4d2c-bf11-56cc3d6e1d39 | add | Please add a benzene ring to the molecule CCCCCCCCCCCCCCCCCCSSN(C)C(=O)O[NH+]=C1SC(C)(C)C(=O)N1C.
Please wrap the final SMILES in <smiles>...</smiles>. | CCCCCCCCCCCCCCCCCCSSN(C)C(=O)O[NH+]=C1SC(C)(C)C(=O)N1C. | CCCCCCCCCCCCCCCCCCSSN(Cc1ccccc1)C(=O)O[NH+]=C1SC(C)(C)C(=O)N1C | benzene | null |
309b1a3d-8d5e-4979-a731-1a46272a6cca | add | Modify the molecule CCCC1CC([NH2+]CC)CN(C(C)C)C1 by adding a benzene ring.
Please wrap the final SMILES in <smiles>...</smiles>. | CCCC1CC([NH2+]CC)CN(C(C)C)C1 | CC[NH2+]C1CC(C(CC)c2ccccc2)CN(C(C)C)C1 | benzene | null |
945ee77f-8b15-427c-93a3-04829d4ef9bb | add | Please add a benzene ring to the molecule CC(C)(C)[Si](C)(C)OC1CCCC(=C2CCCC(=C3CCCC3)CCC2)CCC1.
Please wrap the final SMILES in <smiles>...</smiles>. | CC(C)(C)[Si](C)(C)OC1CCCC(=C2CCCC(=C3CCCC3)CCC2)CCC1. | CC(C)(C)[Si](C)(C)OC1CCCC(=C2CCCC(=C3CCCC3)CC(c3ccccc3)C2)CCC1 | benzene | null |
2e36010a-cbd1-4986-ad0e-34840c467473 | add | Modify the molecule CCOC(=O)C(OC(=O)c1cccc(OC)c1OC)c1ccc(Br)cc1F by adding a benzene ring.
Please wrap the final SMILES in <smiles>...</smiles>. | CCOC(=O)C(OC(=O)c1cccc(OC)c1OC)c1ccc(Br)cc1F | COc1cccc(C(=O)OC(C(=O)OC(C)c2ccccc2)c2ccc(Br)cc2F)c1OC | benzene | null |
5751ef04-7746-416e-95cc-e58550b8036f | add | Modify the molecule COc1ccccc1C=Cc1ccc2cccc(C(=O)[O-])c2n1 by adding a hydroxyl.
Please wrap the final SMILES in <smiles>...</smiles>. | COc1ccccc1C=Cc1ccc2cccc(C(=O)[O-])c2n1 | COc1ccc(O)cc1C=Cc1ccc2cccc(C(=O)[O-])c2n1 | hydroxyl | null |
87184ada-2f20-4da0-bd42-aaf549a66a78 | add | Modify the molecule NC(=O)CCSc1nnc(-c2ccc[nH]2)o1 by adding a benzene ring.
Please wrap the final SMILES in <smiles>...</smiles>. | NC(=O)CCSc1nnc(-c2ccc[nH]2)o1 | NC(=O)C(CSc1nnc(-c2ccc[nH]2)o1c1ccccc1 | benzene | null |
46a1f668-bdc2-49c7-aa85-a10fc7f92586 | add | Please add a carboxyl to the molecule CCC[NH2+]C(C)c1csc(C(CC)(CC)OCC)n1.
Please wrap the final SMILES in <smiles>...</smiles>. | CCC[NH2+]C(C)c1csc(C(CC)(CC)OCC)n1. | CCC[NH2+]C(C)c1csc(C(CC)(OCC)C(C)C(=O)O)n1 | carboxyl | null |
61718d89-863a-493a-a1ff-521a7ecc02b5 | add | Modify the molecule CCOC(=O)COc1ccc(-c2ccc(OCCNC(=O)Cc3ccccc3)c(C(C)C)c2)cc1C(C)C by adding a benzene ring.
Please wrap the final SMILES in <smiles>...</smiles>. | CCOC(=O)COc1ccc(-c2ccc(OCCNC(=O)Cc3ccccc3)c(C(C)C)c2)cc1C(C)C | CCOC(=O)COc1ccc(-c2ccc(OCCNC(=O)Cc3ccccc3)c(C(C)C)c2)cc1C(C)Cc1ccccc1 | benzene | null |
941233fa-b003-48af-8ab9-9ae1132dca97 | add | Please add a hydroxyl to the molecule COc1ccc(CCC(=O)N(CCc2ccccc2)CC(=O)[O-])cc1F.
Please wrap the final SMILES in <smiles>...</smiles>. | COc1ccc(CCC(=O)N(CCc2ccccc2)CC(=O)[O-])cc1F. | COc1cc(O)c(CCC(=O)N(CCc2ccccc2)CC(=O)[O-])cc1F | hydroxyl | null |
5b20495a-3b29-44df-8a66-cfe69be48917 | add | Modify the molecule C[NH+]1CCN(c2ccc(CCCC(=O)N3CCC(c4ccc(Cl)cc4)CC3)cc2)CC1 by adding a carboxyl.
Please wrap the final SMILES in <smiles>...</smiles>. | C[NH+]1CCN(c2ccc(CCCC(=O)N3CCC(c4ccc(Cl)cc4)CC3)cc2)CC1 | C[NH+]1CCN(c2ccc(CCCC(=O)N3CCC(c4ccc(Cl)cc4)CC3C(=O)O)cc2)CC1 | carboxyl | null |
85185204-5c64-4ab2-8a6b-5955cef763c7 | add | Please add a amine to the molecule CN(CCNC(=O)c1ccccc1N(C)C(=O)c1ccc(Br)o1)c1ccccc1.
Please wrap the final SMILES in <smiles>...</smiles>. | CN(CCNC(=O)c1ccccc1N(C)C(=O)c1ccc(Br)o1)c1ccccc1. | CN(CCNC(=O)c1ccccc1N(C)C(=O)c1ccc(Br)o1)c1cccc(N)c1 | amine | null |
081679df-8f05-4eb8-882c-42f1932ab281 | add | Please add a benzene ring to the molecule CC(C)C(C)Sc1nnc(SSc2n[nH]c(=S)s2)s1.
Please wrap the final SMILES in <smiles>...</smiles>. | CC(C)C(C)Sc1nnc(SSc2n[nH]c(=S)s2)s1. | CC(Cc1ccccc1)C(C)Sc1nnc(SSc2n[nH]c(=S)s2)s1 | benzene | null |
ccbdff17-a64f-4038-b0b6-b146b9be5089 | add | Please add a aldehyde to the molecule CC(C)(C)C1c2cncc(n2)C1C(C)(C)C.
Please wrap the final SMILES in <smiles>...</smiles>. | CC(C)(C)C1c2cncc(n2)C1C(C)(C)C. | CC(C)(C)C1c2cncc(n2)C1C(C)(C)CCC=O | aldehyde | null |
29ed2aca-595d-4322-98de-0ebf44f6cf77 | add | Modify the molecule Cc1cc(Oc2cc(C[NH2+]CC(C)C)ccn2)ccc1Br by adding a hydroxyl.
Please wrap the final SMILES in <smiles>...</smiles>. | Cc1cc(Oc2cc(C[NH2+]CC(C)C)ccn2)ccc1Br | Cc1cc(Oc2cc(C(O)[NH2+]CC(C)C)ccn2)ccc1Br | hydroxyl | null |
661d6b2a-1726-4dab-81b0-5ee7e1e4656d | add | Please add a benzene ring to the molecule [NH3+]C1(CNC(=O)CSc2ccccc2)CCCCC1.
Please wrap the final SMILES in <smiles>...</smiles>. | [NH3+]C1(CNC(=O)CSc2ccccc2)CCCCC1. | [NH3+]C1(CNC(=O)CSc2ccccc2)CCC(c3ccccc3)CC1 | benzene | null |
3a8fe8d3-fc0c-47ac-a53f-5a9d66b00c7a | add | Modify the molecule COc1ccccc1OCC(=O)N1CCC(C)C1CO by adding a carboxyl.
Please wrap the final SMILES in <smiles>...</smiles>. | COc1ccccc1OCC(=O)N1CCC(C)C1CO | COc1cc(C(=O)O)ccc1OCC(=O)N1CCC(C)C1CO | carboxyl | null |
483823dc-7bb2-4983-b0f1-94ecc4d6a637 | add | Modify the molecule COc1ccc(CC([NH3+])CCCC(C)C)cn1 by adding a hydroxyl.
Please wrap the final SMILES in <smiles>...</smiles>. | COc1ccc(CC([NH3+])CCCC(C)C)cn1 | COc1c(O)cc(CC([NH3+])CCCC(C)C)cn1 | hydroxyl | null |
a4eee0c0-59b3-4314-a6c0-e11917f964e8 | add | Please add a hydroxyl to the molecule O=C([O-])CC(c1cn[nH]c1)C1CCCCCC1.
Please wrap the final SMILES in <smiles>...</smiles>. | O=C([O-])CC(c1cn[nH]c1)C1CCCCCC1. | O=C([O-])CC(c1cn[nH]c1)C1CCCCC(O)C1 | hydroxyl | null |
75f84072-a929-41a6-88e3-42b605502012 | add | Please add a amine to the molecule CC(C)N1CCCc2cc(C(=CC=O)c3ccccc3)ccc21.
Please wrap the final SMILES in <smiles>...</smiles>. | CC(C)N1CCCc2cc(C(=CC=O)c3ccccc3)ccc21. | CC(C)N1CCCc2cc(C(=CC=O)c3ccccc3)cc(N)c21 | amine | null |
3ec56b8f-0b72-45a3-856b-b30a8018e210 | add | Modify the molecule COCC#CCSc1cnccn1 by adding a hydroxyl.
Please wrap the final SMILES in <smiles>...</smiles>. | COCC#CCSc1cnccn1 | COCC#CCSc1nccnc1O | hydroxyl | null |
d8ef612e-1762-4134-a503-67d1871183dc | add | Modify the molecule C=C1CCCOC1=CC(=CC)C(CC(=O)OC)[NH2+]CC by adding a hydroxyl.
Please wrap the final SMILES in <smiles>...</smiles>. | C=C1CCCOC1=CC(=CC)C(CC(=O)OC)[NH2+]CC | C=C1CCCOC1=CC(=CC)C(CC(=O)OCO)[NH2+]CC | hydroxyl | null |
200a7518-5a48-4bff-95e2-7e25bd75b316 | add | Please add a carboxyl to the molecule C[NH2+]C1CCC(C(C)C)CC1CCOCCCOC.
Please wrap the final SMILES in <smiles>...</smiles>. | C[NH2+]C1CCC(C(C)C)CC1CCOCCCOC. | C[NH2+]C1CCC(C(C)(C)C(=O)O)CC1CCOCCCOC | carboxyl | null |
aa55238e-7ed4-4a4c-b70b-85d046ebdb51 | add | Modify the molecule CCC[NH+]=C(N)NC1Cc2ccccc2C1 by adding a hydroxyl.
Please wrap the final SMILES in <smiles>...</smiles>. | CCC[NH+]=C(N)NC1Cc2ccccc2C1 | CCC[NH+]=C(N)NC1Cc2ccccc2C1O | hydroxyl | null |
25abbcc3-10e0-484f-afa1-e0c0532c411e | add | Please add a hydroxyl to the molecule S=C(S)NCC[NH2+]C(S)S.
Please wrap the final SMILES in <smiles>...</smiles>. | S=C(S)NCC[NH2+]C(S)S. | OC(S)(S)[NH2+]CCNC(=S)S | hydroxyl | null |
521bd605-d8ee-4de6-a34e-7e8cc93f9b92 | add | Modify the molecule CSCCC(CO)NC(c1ccccc1)C(F)(F)F by adding a carboxyl.
Please wrap the final SMILES in <smiles>...</smiles>. | CSCCC(CO)NC(c1ccccc1)C(F)(F)F | CSCCC(CO)NC(c1ccc(C(=O)O)cc1)C(F)(F)F | carboxyl | null |
57b8b5e5-0572-4dda-9c95-d4dc209d3d26 | add | Please add a benzene ring to the molecule NOCCc1cc2c(cc1O)OCO2.
Please wrap the final SMILES in <smiles>...</smiles>. | NOCCc1cc2c(cc1O)OCO2. | NOCCc1cc2c(cc1O)OC(c1ccccc1)O2 | benzene | null |
35420f96-4de3-42ae-9ef8-1e7d8e7ee51e | add | Modify the molecule O=C(Nc1nncs1)c1ccc(N(CCO)C2CCC2)nc1 by adding a hydroxyl.
Please wrap the final SMILES in <smiles>...</smiles>. | O=C(Nc1nncs1)c1ccc(N(CCO)C2CCC2)nc1 | O=C(Nc1nncs1)c1ccc(N(CCO)C2(O)CCC2)nc1 | hydroxyl | null |
0ede56d4-ecd4-4de8-ba93-ec9668dfa0f4 | add | Please add a carboxyl to the molecule CCOc1ccc(NS(=O)(=O)c2cc(C[NH3+])sc2C)cc1.
Please wrap the final SMILES in <smiles>...</smiles>. | CCOc1ccc(NS(=O)(=O)c2cc(C[NH3+])sc2C)cc1. | Cc1sc(C[NH3+])cc1S(=O)(=O)Nc1ccc(OC(C)C(=O)O)cc1 | carboxyl | null |
a014af65-0731-4b05-adb8-0db909f55b64 | add | Modify the molecule CCC(C)CSCC(=O)c1c(C)cc(C)cc1C by adding a hydroxyl.
Please wrap the final SMILES in <smiles>...</smiles>. | CCC(C)CSCC(=O)c1c(C)cc(C)cc1C | CCC(C)C(O)SCC(=O)c1c(C)cc(C)cc1C | hydroxyl | null |
e6f0cecf-bff6-4dd3-9675-43d77ff27126 | add | Please add a hydroxyl to the molecule Cc1nn(C)cc1S(=O)(=O)NCC1CCCC[NH+]1C1CC1.
Please wrap the final SMILES in <smiles>...</smiles>. | Cc1nn(C)cc1S(=O)(=O)NCC1CCCC[NH+]1C1CC1. | Cc1nn(C)cc1S(=O)(=O)NCC1C(O)CCC[NH+]1C1CC1 | hydroxyl | null |
02e4d6b8-d898-41ba-a51a-65a38fdbb1ca | add | Modify the molecule O=C(NCC(CO)Cc1cc(F)ccc1F)c1ccccc1OCc1ccc(F)cc1 by adding a benzene ring.
Please wrap the final SMILES in <smiles>...</smiles>. | O=C(NCC(CO)Cc1cc(F)ccc1F)c1ccccc1OCc1ccc(F)cc1 | O=C(NCC(CO)(Cc1cc(F)ccc1F)c1ccccc1)c1ccccc1OCc1ccc(F)cc1 | benzene | null |
18f9d5ae-0d21-4e1a-97b5-1a224a1bf3de | add | Modify the molecule C=C(C)C1CCC2([NH2+]CCN3CCN(S(C)(=O)=O)CC3)CCC3(C)C(CCC4C5(C)CC=C(C6=CCC(CF)(C(=O)OCc7ccccc7)CC6)C(C)(C)C5CCC43C)C12 by adding a carboxyl.
Please wrap the final SMILES in <smiles>...</smiles>. | C=C(C)C1CCC2([NH2+]CCN3CCN(S(C)(=O)=O)CC3)CCC3(C)C(CCC4C5(C)CC=C(C6=CCC(CF)(C(=O)OCc7ccccc7)CC6)C(C)(C)C5CCC43C)C12 | C=C(C)C1CCC2([NH2+]CCN3CCN(S(C)(=O)=O)CC3)CCC3(C)C(CCC4C5(C)CC=C(C6=CCC(CF)(C(=O)OCc7ccccc7)CC6)C(C)(CC(=O)O)C5CCC43C)C12 | carboxyl | null |
cf823295-cf05-4bbf-9125-f0fc5da85955 | add | Modify the molecule CCN(CCCC[NH2+]C(C)C)c1ccccc1C by adding a amine.
Please wrap the final SMILES in <smiles>...</smiles>. | CCN(CCCC[NH2+]C(C)C)c1ccccc1C | CCN(c1ccccc1C)C(N)CCC[NH2+]C(C)C | amine | null |
22b9e4af-7c03-4637-a161-837fe9b635ba | add | Modify the molecule NP(OCCCCCCSC(c1ccccc1)(c1ccccc1)c1ccccc1)OCCCCCCSC(c1ccccc1)(c1ccccc1)c1ccccc1 by adding a benzene ring.
Please wrap the final SMILES in <smiles>...</smiles>. | NP(OCCCCCCSC(c1ccccc1)(c1ccccc1)c1ccccc1)OCCCCCCSC(c1ccccc1)(c1ccccc1)c1ccccc1 | NP(OCCCCCCSC(c1ccccc1)(c1ccccc1)c1ccccc1)OCCCCCCSC(c1ccccc1)(c1ccccc1)c1cccc(-c2ccccc2)c1 | benzene | null |
30bac567-8d34-43a7-848f-dbe429ecfe17 | add | Modify the molecule C=CC(C)([NH3+])c1ccc(F)cc1Cl by adding a amine.
Please wrap the final SMILES in <smiles>...</smiles>. | C=CC(C)([NH3+])c1ccc(F)cc1Cl | C=C(N)C(C)([NH3+])c1ccc(F)cc1Cl | amine | null |
d2bc786b-40f5-4901-8d91-5caf03aa2479 | add | Modify the molecule CCOC1CC(Nc2ccc3cn[nH]c3c2)C12CCCC2 by adding a benzene ring.
Please wrap the final SMILES in <smiles>...</smiles>. | CCOC1CC(Nc2ccc3cn[nH]c3c2)C12CCCC2 | CCOC1CC(Nc2ccc3c(-c4ccccc4)n[nH]c3c2)C12CCCC2 | benzene | null |
ce3189b2-054f-40b6-9567-4d96ee442c49 | add | Modify the molecule COc1ccc(C(C[NH3+])N2CCCC2)c(Cl)c1 by adding a amine.
Please wrap the final SMILES in <smiles>...</smiles>. | COc1ccc(C(C[NH3+])N2CCCC2)c(Cl)c1 | COc1ccc(C(C[NH3+])N2CCCC2)c(Cl)c1N | amine | null |
5342a98e-e737-456c-b94a-ec0b673af05e | add | Modify the molecule CCCCCC(C)(C[NH3+])N(CCCOC)CCOC by adding a benzene ring.
Please wrap the final SMILES in <smiles>...</smiles>. | CCCCCC(C)(C[NH3+])N(CCCOC)CCOC | CCCCCC(C)(C[NH3+])N(CCOC)CCC(OC)c1ccccc1 | benzene | null |
8fea7fc9-c1dd-4de0-9f9e-91043d34caf1 | add | Modify the molecule C=CCCCCCCCc1nnc(-c2ccccc2)c(-c2ccccc2)n1 by adding a benzene ring.
Please wrap the final SMILES in <smiles>...</smiles>. | C=CCCCCCCCc1nnc(-c2ccccc2)c(-c2ccccc2)n1 | C=CCCCCCC(Cc1nnc(-c2ccccc2)c(-c2ccccc2)n1)c1ccccc1 | benzene | null |
92e28a76-859b-4a89-802b-8c890990d744 | add | Modify the molecule CNc1cc[nH+]c(C(=O)N(C)CC[NH+]2CCCC2)c1 by adding a benzene ring.
Please wrap the final SMILES in <smiles>...</smiles>. | CNc1cc[nH+]c(C(=O)N(C)CC[NH+]2CCCC2)c1 | CNc1cc[nH+]c(C(=O)N(C)CC(c2ccccc2)[NH+]2CCCC2)c1 | benzene | null |
f45afaf6-34c9-4d82-9325-5c9a0cc096b8 | add | Please add a benzene ring to the molecule CCOc1ccc(C(CC)[NH+]2CCCC(C(=O)[O-])C2)cc1OC.
Please wrap the final SMILES in <smiles>...</smiles>. | CCOc1ccc(C(CC)[NH+]2CCCC(C(=O)[O-])C2)cc1OC. | CCOc1ccc(C(CC)(c2ccccc2)[NH+]2CCCC(C(=O)[O-])C2)cc1OC | benzene | null |
57145fcd-b54d-415c-84c3-87b0cb8bf45c | add | Modify the molecule CCC(CC)n1ccc(CC(C)C(=O)c2ccccc2)n1 by adding a carboxyl.
Please wrap the final SMILES in <smiles>...</smiles>. | CCC(CC)n1ccc(CC(C)C(=O)c2ccccc2)n1 | CCC(CC)n1ccc(CC(C)C(=O)c2ccccc2C(=O)O)n1 | carboxyl | null |
95552d78-6093-4f82-83cd-98181823c463 | add | Modify the molecule Cc1ccc2[se]n(C3CCC(n4[se]c5ccc(C)cc5c4=O)CC3)c(=O)c2c1 by adding a amine.
Please wrap the final SMILES in <smiles>...</smiles>. | Cc1ccc2[se]n(C3CCC(n4[se]c5ccc(C)cc5c4=O)CC3)c(=O)c2c1 | Cc1ccc2[se]n(C3CCC(n4[se]c5ccc(C)cc5c4=O)C(N)C3)c(=O)c2c1 | amine | null |
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