smiles	zinc_id	prot_id	files.db2	substance.inchikey	net_charge	ph_mod_fk	substance.mwt	substance.logp	purchasable	reactive	features	tranche_name
Oc1ccccc1C[NH+]1CCC(O)(c2csc(C[N@H+]3CC[C@@H](O)C3)n2)CC1	ZINC000225465225	206050121	/nfs/dbraw/zinc/05/01/21/206050121.db2.gz	VZOWCDICFPCQFI-MRXNPFEDSA-N	2	2	389.521	1.899	40	10	biogenic,in-vitro	GDCBLP
Oc1ccccc1C[NH+]1CCC(O)(c2csc(C[N@@H+]3CC[C@@H](O)C3)n2)CC1	ZINC000225465225	206050128	/nfs/dbraw/zinc/05/01/28/206050128.db2.gz	VZOWCDICFPCQFI-MRXNPFEDSA-N	2	2	389.521	1.899	40	10	biogenic,in-vitro	GDCBLP
Cc1cc(N2CCOCC2)ccc1C[N@@H+]1CCC[C@H](c2nnc3n2CC[NH2+]C3)C1	ZINC000019711049	210285102	/nfs/dbraw/zinc/28/51/02/210285102.db2.gz	ABWSBKABXJQJBR-IBGZPJMESA-N	2	2	396.539	1.906	40	10		GDCBLP
Cc1cc(N2CCOCC2)ccc1C[N@H+]1CCC[C@H](c2nnc3n2CC[NH2+]C3)C1	ZINC000019711049	210285106	/nfs/dbraw/zinc/28/51/06/210285106.db2.gz	ABWSBKABXJQJBR-IBGZPJMESA-N	2	2	396.539	1.906	40	10		GDCBLP
Cc1cc(N2CCOCC2)ccc1C[N@@H+]1CCC[C@@H](c2nnc3n2CC[NH2+]C3)C1	ZINC000019711048	571035261	/nfs/dbraw/zinc/03/52/61/571035261.db2.gz	ABWSBKABXJQJBR-LJQANCHMSA-N	2	2	396.539	1.906	40	10		GDCBLP
Cc1cc(N2CCOCC2)ccc1C[N@H+]1CCC[C@@H](c2nnc3n2CC[NH2+]C3)C1	ZINC000019711048	571035264	/nfs/dbraw/zinc/03/52/64/571035264.db2.gz	ABWSBKABXJQJBR-LJQANCHMSA-N	2	2	396.539	1.906	40	10		GDCBLP