smiles zinc_id prot_id files.db2 substance.inchikey net_charge ph_mod_fk substance.mwt substance.logp purchasable reactive features tranche_name CCOc1ccc2c([O-])csc2c1 343064 351276102 /nfs/dbraw/zinc/27/61/02/351276102.db2.gz IKSIVAMIINQNBN-UHFFFAOYSA-N -1 0 194.255 3.006 50 10 AGCARM