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(/C=C/c1ccccc1)c1cc(C(=O)/C=C/c2ccccc2)c(O)cc1[O-] ZINC000012418129 206291106 /nfs/dbraw/zinc/29/11/06/206291106.db2.gz CAAJXTJDBCGUNB-PHEQNACWSA-N -1 2 370.404 4.890 50 30 FJEALM CC(C)c1ccc(/C=C2\Oc3c(ccc(O)c3C[NH+]3CCCC3)C2=O)cc1 ZINC000020649409 220337766 /nfs/dbraw/zinc/33/77/66/220337766.db2.gz GCLSXEBXAMIOTQ-BKUYFWCQSA-N -1 2 363.457 4.728 50 30 FJEALM