smiles zinc_id prot_id files.db2 substance.inchikey net_charge ph_mod_fk substance.mwt substance.logp purchasable reactive features tranche_name c1ccc2c(c1)cc1ccccc1c2C[NH2+]C1CC1 ZINC000060815259 640890661 /nfs/dbraw/zinc/89/06/61/640890661.db2.gz VVOFABRBKYBWAI-UHFFFAOYSA-N 1 0 247.341 4.245 20 5 BIBDRO CC[NH2+]Cc1c2ccccc2cc2ccccc21 ZINC000061003210 640908718 /nfs/dbraw/zinc/90/87/18/640908718.db2.gz WIFMXUVIAIYETC-UHFFFAOYSA-N 1 0 235.330 4.103 20 5 BIBDRO