smiles zinc_id prot_id files.db2 substance.inchikey net_charge ph_mod_fk substance.mwt substance.logp purchasable reactive features tranche_name COc1cc(OC)c(-c2coc3c4c(cc([O-])c3c2=O)OC(C)(C)C=C4)cc1OC ZINC000002561275 569277923 /nfs/dbraw/zinc/27/79/23/569277923.db2.gz WNIRAQXHOVJVDB-UHFFFAOYSA-N -1 1 410.422 4.376 30 0 HIACMM COc1cc(OC)c(-c2coc3c4c(cc(=O)c-3c2[O-])OC(C)(C)C=C4)cc1OC ZINC000002561275 569277926 /nfs/dbraw/zinc/27/79/26/569277926.db2.gz WNIRAQXHOVJVDB-UHFFFAOYSA-N -1 1 410.422 4.376 30 0 HIACMM