smiles zinc_id prot_id files.db2 substance.inchikey net_charge ph_mod_fk substance.mwt substance.logp purchasable reactive features tranche_name Cc1nc(CN2C[C@H](O)C[C@@H]2c2cccc(C(F)(F)F)c2)oc1C ZINC000161027663 564091350 /nfs/dbraw/zinc/09/13/50/564091350.db2.gz IXEPLILFPMCBGO-HUUCEWRRSA-N 0 0 340.345 3.618 20 70 EHIDRN Cc1nc(CN2C[C@@H](O)C[C@@H]2c2cccc(C(F)(F)F)c2)oc1C ZINC000161027796 564091371 /nfs/dbraw/zinc/09/13/71/564091371.db2.gz IXEPLILFPMCBGO-LSDHHAIUSA-N 0 0 340.345 3.618 20 70 EHIDRN O=C(C1CCN(CC(F)(F)F)CC1)N1CCc2c1cccc2Cl ZINC000161460331 257955698 /nfs/dbraw/zinc/95/56/98/257955698.db2.gz SRBNQCTUFZMGPB-UHFFFAOYSA-N 0 0 346.780 3.503 20 70 EHIDRN COc1ccc2oc([C@H](C)NC(=O)N3C[C@H](C)O[C@@H](C)C3)c(C)c2c1 ZINC000216962799 537057033 /nfs/dbraw/zinc/05/70/33/537057033.db2.gz CMEKRFMFILBMHQ-OBJOEFQTSA-N 0 0 346.427 3.630 20 70 EHIDRN