smiles zinc_id prot_id files.db2 substance.inchikey net_charge ph_mod_fk substance.mwt substance.logp purchasable reactive features tranche_name COC(=O)CNC(=O)CNC(=O)[C@H]1CC(=O)c2oc(=O)c3cc(O)c(O)c(O)c3c21 ZINC001185559630 1071831770 /nfs/dbraw/zinc/83/17/70/1071831770.db2.gz YHNALWRRMGQGKF-LURJTMIESA-N 0 2 420.330 -1.015 20 10 HACDLN COC(=O)CNC(=O)CNC(=O)[C@@H]1CC(=O)c2oc(=O)c3cc(O)c(O)c(O)c3c21 ZINC001185559631 1071831802 /nfs/dbraw/zinc/83/18/02/1071831802.db2.gz YHNALWRRMGQGKF-ZCFIWIBFSA-N 0 2 420.330 -1.015 20 10 HACDLN