smiles zinc_id prot_id files.db2 substance.inchikey net_charge ph_mod_fk substance.mwt substance.logp purchasable reactive features tranche_name CCCCCc1c(C)nc2c(C)cccc2c1Nc1ccccc1C ZINC000217443676 535140891 /nfs/dbraw/zinc/14/08/91/535140891.db2.gz AVCKZGHAPAFYJX-UHFFFAOYSA-N 0 3 332.491 6.636 40 70 EKIBHN