smiles zinc_id prot_id files.db2 substance.inchikey net_charge ph_mod_fk substance.mwt substance.logp purchasable reactive features tranche_name Cc1cc2[nH]c(=O)[nH]c2cc1N=NC1C(=O)NC(=O)NC1=O ZINC000100051466 392492324 /nfs/dbraw/zinc/49/23/24/392492324.db2.gz RITYHZCLJGBCAJ-ISLYRVAYSA-N 0 2 302.250 -0.017 10 10 DBCELN