smiles zinc_id prot_id files.db2 substance.inchikey net_charge ph_mod_fk substance.mwt substance.logp purchasable reactive features tranche_name CC(C)=CCc1c(=O)cc2oc3cc([O-])c4c(c3c(O)c-2c1O)CCC(C)(C)O4 ZINC000015252166 207050382 /nfs/dbraw/zinc/05/03/82/207050382.db2.gz VEUQWGPUUYXBDE-UHFFFAOYSA-N -1 2 396.439 4.675 1 5 biogenic,in-vitro GJBFLM CC1(C)CC2(CC(C)(C)c3cc([N+](=O)[O-])c(O)cc32)c2cc([O-])c([N+](=O)[O-])cc21 ZINC000026154851 207310286 /nfs/dbraw/zinc/31/02/86/207310286.db2.gz ZHJVMMFKPYUQIQ-UHFFFAOYSA-N -1 2 398.415 4.563 1 5 GJBFLM