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=C/c1cc2ccccc2c2ccccc12 ZINC000001577092 182412018 /nfs/dbraw/zinc/41/20/18/182412018.db2.gz GBCYQLRBIJCAHQ-MDZDMXLPSA-N -1 0 248.281 4.091 40 5 BIBBRM [S-]c1c2ccccc2cc2ccccc21 ZINC000001653872 383917638 /nfs/dbraw/zinc/91/76/38/383917638.db2.gz CTUXILQBEJGEAT-UHFFFAOYSA-N -1 0 210.301 4.282 40 5 BIBBRM O=C([O-])/C=C\c1cc2ccccc2c2ccccc12 ZINC000016891522 182415114 /nfs/dbraw/zinc/41/51/14/182415114.db2.gz GBCYQLRBIJCAHQ-KTKRTIGZSA-N -1 0 248.281 4.091 40 5 BIBBRM O=C([O-])/C=C\c1c2ccccc2cc2ccccc21 ZINC000016891793 384474202 /nfs/dbraw/zinc/47/42/02/384474202.db2.gz VQEMICCPCDGMGE-KTKRTIGZSA-N -1 0 248.281 4.091 40 5 BIBBRM