smiles	zinc_id	prot_id	files.db2	substance.inchikey	net_charge	ph_mod_fk	substance.mwt	substance.logp	purchasable	reactive	features	tranche_name
Cn1c2nc([N-]N=C3C(=O)[N-]C(=O)NC3=O)n(Cc3ccccc3)c2c(=O)n(C)c1=O	ZINC000017250054	560705002	/nfs/dbraw/zinc/70/50/02/560705002.db2.gz	PDTNDQIFNRLPGD-UHFFFAOYSA-N	-2	3	424.377	-0.544	50	30		HBEAHL
CN(C)[C@@H]1C([O-])=C(C(N)=O)C(=O)[C@@]2(O)C(=O)C3=C([O-])c4c(O)cccc4C[C@H]3C[C@@H]12	ZINC000103941901	568929172	/nfs/dbraw/zinc/92/91/72/568929172.db2.gz	MTCQOMXDZUULRV-ADOAZJKMSA-N	-2	3	414.414	-0.036	50	30		HBEAHL
CN(C)[C@@H]1C(=O)C(C(N)=O)=C([O-])[C@@]2(O)C(=O)C3=C([O-])c4c(O)cccc4C[C@H]3C[C@@H]12	ZINC000103941901	568929170	/nfs/dbraw/zinc/92/91/70/568929170.db2.gz	MTCQOMXDZUULRV-ADOAZJKMSA-N	-2	3	414.414	-0.036	50	30		HBEAHL