smiles zinc_id prot_id files.db2 substance.inchikey net_charge ph_mod_fk substance.mwt substance.logp purchasable reactive features tranche_name C[N@H+](Cc1n[nH]c(=O)[nH]1)Cc1ccccc1O ZINC000091619342 345601297 /nfs/dbraw/zinc/60/12/97/345601297.db2.gz MKAIHZYEJKLWNJ-UHFFFAOYSA-N -2 2 234.259 0.848 20 10 BCCDLL