smiles zinc_id prot_id files.db2 substance.inchikey net_charge ph_mod_fk substance.mwt substance.logp purchasable reactive features tranche_name Cn1c2c([nH]c1=NNC=C1C(=O)NC(=O)N(C(C)(C)C)C1=O)n(C)c(=O)n(C)c2=O ZINC000009327445 571248137 /nfs/dbraw/zinc/24/81/37/571248137.db2.gz LEUWNYFNFCQSPG-BQYQJAHWSA-N 0 1 418.414 -1.352 50 10 HACAMN CCCCN1C(=O)NC(=O)C(=CNN=c2[nH]c3c(c(=O)n(C)c(=O)n3C)n2C)C1=O ZINC000017249440 560704976 /nfs/dbraw/zinc/70/49/76/560704976.db2.gz QLVDKNRLRYUDSR-HJWRWDBZSA-N 0 1 418.414 -1.146 50 10 HACAMN