Added 1 molecules from epoch 18665 to P23975_molecules_TEST.csv
Browse files
P23975_molecules_TEST.csv
CHANGED
|
@@ -7,3 +7,4 @@ rxn:2:85745:96467,CCc1ccc(C(CC(C)Nc2ccc(Sc3nc(C)cs3)cc2)N(C)C)cc1,ZIFYDTCRQHRZFU
|
|
| 7 |
rxn:4:200988:223588,COC(OC)c1cc2cc(-c3cnc(N4CCN(C(=O)OC(C)(C)C)CC4)c(C)c3)cnc2n1S(=O)(=O)c1ccccc1,LODOMPYHCGOAKM-UHFFFAOYSA-N
|
| 8 |
rxn:4:180174:227665,Cc1cc(-c2ccc(C[Si](C)(C)C)cc2)ccc1C(F)(F)F,VLBQEEVVFSWWCJ-UHFFFAOYSA-N
|
| 9 |
rxn:2:88914:69181,Cc1ccc(-n2nc(C)c(C)c2NC2CCN(Cc3ccccc3)C2(C)C)cc1,UJXGHANULLZENU-UHFFFAOYSA-N
|
|
|
|
|
|
| 7 |
rxn:4:200988:223588,COC(OC)c1cc2cc(-c3cnc(N4CCN(C(=O)OC(C)(C)C)CC4)c(C)c3)cnc2n1S(=O)(=O)c1ccccc1,LODOMPYHCGOAKM-UHFFFAOYSA-N
|
| 8 |
rxn:4:180174:227665,Cc1cc(-c2ccc(C[Si](C)(C)C)cc2)ccc1C(F)(F)F,VLBQEEVVFSWWCJ-UHFFFAOYSA-N
|
| 9 |
rxn:2:88914:69181,Cc1ccc(-n2nc(C)c(C)c2NC2CCN(Cc3ccccc3)C2(C)C)cc1,UJXGHANULLZENU-UHFFFAOYSA-N
|
| 10 |
+
rxn:2:89622:172608,Cc1ccc(-c2cccc3c2C(NCC2CCn4cccc42)CC3)c(C)c1,UMIJTGIRAWTVIP-UHFFFAOYSA-N
|