smiles	zinc_id	prot_id	files.db2	substance.inchikey	net_charge	ph_mod_fk	substance.mwt	substance.logp	purchasable	reactive	features	tranche_name
O=C(c1ccc2c3nc4ccccc4n3c(=S)[nH]c2c1)N1CCN(c2cccc[nH+]2)CC1	ZINC000020643525	526731032	/nfs/dbraw/zinc/73/10/32/526731032.db2.gz	DDQDCKDPKCZBGS-UHFFFAOYSA-N	1	2	440.532	3.682	10	5		IHBELO
COc1ccc(-n2c(C[NH+]3CCC(C)CC3)nc3ccc([N+](=O)[O-])cc3c2=O)c(OC)c1	ZINC000013574104	562994400	/nfs/dbraw/zinc/99/44/00/562994400.db2.gz	YNKXQNBEBKTYCN-UHFFFAOYSA-N	1	2	438.484	3.543	10	5		IHBELO