smiles	zinc_id	prot_id	files.db2	substance.inchikey	net_charge	ph_mod_fk	substance.mwt	substance.logp	purchasable	reactive	features	tranche_name
NC(=O)C1CC[NH+]([C@H]2[C@@H]3OC[C@@H](O3)[C@@H]([NH2+]Cc3ccccc3O)[C@@H]2O)CC1	ZINC000012529667	291097663	/nfs/dbraw/zinc/09/76/63/291097663.db2.gz	NAMJLSZEXJBDMC-ZQOJQMTGSA-N	2	2	377.441	-0.468	40	10	biogenic,in-vitro	GBCBLP
Cc1cc(CN2CC[NH+](CCO)CC2)c(O)c(C[NH+]2CCN(CCO)CC2)c1	ZINC000019365154	210244904	/nfs/dbraw/zinc/24/49/04/210244904.db2.gz	CICIDLFQOZMTLL-UHFFFAOYSA-N	2	2	392.544	-0.080	40	10		GBCBLP
Cc1cc(C[NH+]2CCN(CCO)CC2)c(O)c(C[NH+]2CCN(CCO)CC2)c1	ZINC000019365154	210244899	/nfs/dbraw/zinc/24/48/99/210244899.db2.gz	CICIDLFQOZMTLL-UHFFFAOYSA-N	2	2	392.544	-0.080	40	10		GBCBLP