smiles zinc_id prot_id files.db2 substance.inchikey net_charge ph_mod_fk substance.mwt substance.logp purchasable reactive features tranche_name Fc1ccc(Cn2c3ccccc3nc2NC2CCN(CCN3CCC(Nc4nc5ccccc5n4Cc4ccc(F)cc4)CC3)CC2)cc1 ZINC000160691687 571530766 /nfs/dbraw/zinc/53/07/66/571530766.db2.gz TXSIEQLVBBRJCX-UHFFFAOYSA-N 0 3 674.844 7.214 50 70 KKIAHN