smiles zinc_id prot_id files.db2 substance.inchikey net_charge ph_mod_fk substance.mwt substance.logp purchasable reactive features tranche_name CCCCCCCCOc1ccc(C(=O)c2ccccc2[O-])c([O-])c1 ZINC000002025371 563418288 /nfs/dbraw/zinc/41/82/88/563418288.db2.gz XRCGPZWJUXJKJF-UHFFFAOYSA-N -2 0 342.435 5.068 50 30 EKEARL CCCCCCCCCCCCCC/C=C/[C@@H](CC(=O)[O-])C(=O)[O-] ZINC000059429938 563949035 /nfs/dbraw/zinc/94/90/35/563949035.db2.gz AAHZZGHPCKJNNZ-ZPICJPFVSA-N -2 0 340.504 5.809 50 30 EKEARL CCCCCCCCCCCCCC/C=C/[C@H](CC(=O)[O-])C(=O)[O-] ZINC000059429939 563949060 /nfs/dbraw/zinc/94/90/60/563949060.db2.gz AAHZZGHPCKJNNZ-WXWBBQJKSA-N -2 0 340.504 5.809 50 30 EKEARL CCCCCCCCCCCCC/C=C/C[C@@H](CC(=O)[O-])C(=O)[O-] ZINC000100167236 219093314 /nfs/dbraw/zinc/09/33/14/219093314.db2.gz OEFYCSSKUNVOSE-JJJPLKNQSA-N -2 0 340.504 5.809 50 30 EKEARL CCCCCCCCCCCCC/C=C/C[C@H](CC(=O)[O-])C(=O)[O-] ZINC000100167237 563982395 /nfs/dbraw/zinc/98/23/95/563982395.db2.gz OEFYCSSKUNVOSE-LGHUBQEGSA-N -2 0 340.504 5.809 50 30 EKEARL