smiles zinc_id prot_id files.db2 substance.inchikey net_charge ph_mod_fk substance.mwt substance.logp purchasable reactive features tranche_name COCc1ccc(C(=O)N[C@H](C)c2ccc(Cl)c(Cl)c2)o1 ZINC000160140612 206281488 /nfs/dbraw/zinc/28/14/88/206281488.db2.gz KAOVHNMFBGYXFN-SECBINFHSA-N 0 0 328.195 4.224 10 70 EIIERN COC(=O)c1nc(-c2ccc3ccccc3c2)cc(C(F)(F)F)n1 ZINC000217036054 536857928 /nfs/dbraw/zinc/85/79/28/536857928.db2.gz YWVDFDPLGBAJBD-UHFFFAOYSA-N 0 0 332.281 4.102 10 70 EIIERN COCc1ccc(C(=O)N[C@@H](C)c2ccc(Cl)c(Cl)c2)o1 ZINC000160140474 225346378 /nfs/dbraw/zinc/34/63/78/225346378.db2.gz KAOVHNMFBGYXFN-VIFPVBQESA-N 0 0 328.195 4.224 10 70 EIIERN COC(=O)c1nc(-c2cccc3ccccc32)cc(C(F)(F)F)n1 ZINC000217036107 536857719 /nfs/dbraw/zinc/85/77/19/536857719.db2.gz CCFKMWQYNJJQDC-UHFFFAOYSA-N 0 0 332.281 4.102 10 70 EIIERN