smiles zinc_id prot_id files.db2 substance.inchikey net_charge ph_mod_fk substance.mwt substance.logp purchasable reactive features tranche_name Cc1c([O-])c2cc([O-])c3c(=O)c4c([O-])cccc4c(=O)c3c2c(=O)c1=O ZINC000014814490 560226567 /nfs/dbraw/zinc/22/65/67/560226567.db2.gz LRVJUCBWMNTDLP-UHFFFAOYSA-N -3 3 350.282 0.888 1 5 in-vitro FCBFHL Cc1c([O-])c(=O)c2c(cc([O-])c3c(=O)c4c([O-])cccc4c(=O)c32)c1=O ZINC000014814490 560226568 /nfs/dbraw/zinc/22/65/68/560226568.db2.gz LRVJUCBWMNTDLP-UHFFFAOYSA-N -3 3 350.282 0.888 1 5 in-vitro FCBFHL