smiles zinc_id prot_id files.db2 substance.inchikey net_charge ph_mod_fk substance.mwt substance.logp purchasable reactive features tranche_name C[C@](OC(=O)/C=C/c1ccc(O)c(O)c1)(C(=O)[O-])[C@H](O)CO ZINC000014814642 290887681 /nfs/dbraw/zinc/88/76/81/290887681.db2.gz VFNQXFLXWICPJF-UOLJMSNASA-N -1 0 312.274 -0.149 10 10 biogenic DBCERM Cc1cc2[nH]c(=O)[nH]c2cc1N=Nc1c([O-])[nH]c(=O)[nH]c1=O ZINC000100051466 392492299 /nfs/dbraw/zinc/49/22/99/392492299.db2.gz RITYHZCLJGBCAJ-ISLYRVAYSA-N -1 0 302.250 -0.017 10 10 DBCERM