smiles zinc_id prot_id files.db2 substance.inchikey net_charge ph_mod_fk substance.mwt substance.logp purchasable reactive features tranche_name O=[N+]([O-])c1cc(Br)c(NC[C@@H](O)COCc2ccccc2)cc1F ZINC000504439934 231318481 /nfs/dbraw/zinc/31/84/81/231318481.db2.gz LJAHPSMJKVOOLY-GFCCVEGCSA-N 0 0 399.216 3.486 30 5 GGBCRN O=[N+]([O-])c1cc(Br)c(NC[C@H](O)COCc2ccccc2)cc1F ZINC000504439935 231319037 /nfs/dbraw/zinc/31/90/37/231319037.db2.gz LJAHPSMJKVOOLY-LBPRGKRZSA-N 0 0 399.216 3.486 30 5 GGBCRN