smiles	zinc_id	prot_id	files.db2	substance.inchikey	net_charge	ph_mod_fk	substance.mwt	substance.logp	purchasable	reactive	features	tranche_name
CN1CCN(Cc2nc(C3(O)CC[NH+](Cc4ccccc4O)CC3)cs2)CC1	ZINC000225471976	291205476	/nfs/dbraw/zinc/20/54/76/291205476.db2.gz	ZHLRMWBIHYESCP-UHFFFAOYSA-N	2	0	402.564	2.080	40	10	biogenic,in-vitro	HECBRP
CNc1cc(C[N@H+](C)Cc2ccc(N3CCOCC3)cc2)nc(C2CC[NH2+]CC2)n1	ZINC000019710115	558971826	/nfs/dbraw/zinc/97/18/26/558971826.db2.gz	ZGIOIJRBVLNFQN-UHFFFAOYSA-N	2	0	410.566	2.454	40	10		HECBRP
CC[NH+](CC)CCn1c(C)nc2c1C(=O)c1nc(C)n(CC[NH+](CC)CC)c1C2=O	ZINC000001691618	557281118	/nfs/dbraw/zinc/28/11/18/557281118.db2.gz	CDRRQRSBNBNLHB-UHFFFAOYSA-N	2	0	414.554	2.155	40	10		HECBRP