smiles zinc_id prot_id files.db2 substance.inchikey net_charge ph_mod_fk substance.mwt substance.logp purchasable reactive features tranche_name O=C([O-])CC[N@H+](CC(=O)NNC(=O)c1ccccc1)Cc1ccccc1 ZINC000701292706 977002078 /nfs/dbraw/zinc/00/20/78/977002078.db2.gz ZIHCXVANLWMTGK-UHFFFAOYSA-N 0 1 355.394 1.425 10 50 FDGEMN O=C([O-])CC[N@@H+](CC(=O)NNC(=O)c1ccccc1)Cc1ccccc1 ZINC000701292706 977002090 /nfs/dbraw/zinc/00/20/90/977002090.db2.gz ZIHCXVANLWMTGK-UHFFFAOYSA-N 0 1 355.394 1.425 10 50 FDGEMN