smiles	zinc_id	prot_id	files.db2	substance.inchikey	net_charge	ph_mod_fk	substance.mwt	substance.logp	purchasable	reactive	features	tranche_name
COC(=O)[C@@]12O[C@@H]1C=Cc1oc3cc(CO)cc(=O)c-3c(O)c12	ZINC000005605991	181262749	/nfs/dbraw/zinc/26/27/49/181262749.db2.gz	DYSASOJNGXSFHH-BDJLRTHQSA-N	0	2	316.265	0.785	1	30		DCEFLN
O=C1N[C@@H](CS)C(=O)N2Cc3[nH]c4ccccc4c3C[C@@H]12	ZINC000028654897	182534455	/nfs/dbraw/zinc/53/44/55/182534455.db2.gz	ABDMKDGWSLYMLS-STQMWFEESA-N	0	2	301.371	0.849	1	30		DCEFLN
Cc1ccccc1NC(=O)C(C#N)=N[N-]c1[nH+]c[nH]c1C(N)=O	ZINC000005542750	181255151	/nfs/dbraw/zinc/25/51/51/181255151.db2.gz	VQVAMGLVGZTTQM-JMIUGGIZSA-N	0	2	311.305	0.747	1	30		DCEFLN