smiles zinc_id prot_id files.db2 substance.inchikey net_charge ph_mod_fk substance.mwt substance.logp purchasable reactive features tranche_name O=C([O-])C(=C1OC(=O)C(c2ccc(O)c(O)c2)=C1O)c1ccc(O)cc1 ZINC000014885485 571726878 /nfs/dbraw/zinc/72/68/78/571726878.db2.gz LJVSOLKVNIGBDE-JQIJEIRASA-N -1 2 356.286 2.125 1 10 endogenous,in-man FECFLM O=c1oc2cc(O)c(O)cc2c2c1[nH]c1c2c2cc(O)c(O)cc2oc1=O ZINC000014613984 210181221 /nfs/dbraw/zinc/18/12/21/210181221.db2.gz TZFRSABFINCNDG-UHFFFAOYSA-N -1 2 367.269 2.356 1 10 FECFLM COc1cc2c(c(O)c1Cl)C(=O)c1c(O)cc(C[C@H](C)O)cc1C2=O ZINC000014819816 210182127 /nfs/dbraw/zinc/18/21/27/210182127.db2.gz FKVUTJLGAVQJOM-ZETCQYMHSA-N -1 2 362.765 2.459 1 10 FECFLM