smiles	zinc_id	prot_id	files.db2	substance.inchikey	net_charge	ph_mod_fk	substance.mwt	substance.logp	purchasable	reactive	features	tranche_name
CCC(CC)C[N@@H+](CC)c1ccc(C[NH3+])cc1C	ZINC000037733268	168349899	/nfs/dbraw/zinc/34/98/99/168349899.db2.gz	WQRFMMBUKQJNHA-UHFFFAOYSA-N	2	2	248.414	3.716	10	10		BHCELP
CCC(CC)C[N@H+](CC)c1ccc(C[NH3+])cc1C	ZINC000037733268	168349898	/nfs/dbraw/zinc/34/98/98/168349898.db2.gz	WQRFMMBUKQJNHA-UHFFFAOYSA-N	2	2	248.414	3.716	10	10		BHCELP
CCC[NH+](CCC)c1ccc(C[NH2+]CC)cc1C	ZINC000050559844	169152986	/nfs/dbraw/zinc/15/29/86/169152986.db2.gz	QSAOQYSWKHLGFR-UHFFFAOYSA-N	2	2	248.414	3.731	10	10		BHCELP