smiles zinc_id prot_id files.db2 substance.inchikey net_charge ph_mod_fk substance.mwt substance.logp purchasable reactive features tranche_name CC(C)Cn1c([N-]N=C2C(=O)NC(=O)NC2=O)nc2c1c(=O)[nH]c(=O)n2C ZINC000009292742 519487719 /nfs/dbraw/zinc/48/77/19/519487719.db2.gz RMNUENYMZFKPAH-UHFFFAOYSA-N -1 1 376.333 -1.787 50 30 GAEAMM Cn1c2nc([N-]N=C3C(=O)N(C)C(=O)N(C)C3=O)n(CCO)c2c(=O)[nH]c1=O ZINC000009849194 206373530 /nfs/dbraw/zinc/37/35/30/206373530.db2.gz ZCBSXPROWQSDJC-UHFFFAOYSA-N -1 1 392.332 -2.766 50 30 GAEAMM CC(C)n1c([N-]N=C2C(=O)N(C)C(=O)N(C)C2=O)nc2c1c(=O)[nH]c(=O)n2C ZINC000009849202 212235089 /nfs/dbraw/zinc/23/50/89/212235089.db2.gz VZMZVPCEQJTGNF-UHFFFAOYSA-N -1 1 390.360 -1.178 50 30 GAEAMM