smiles	zinc_id	prot_id	files.db2	substance.inchikey	net_charge	ph_mod_fk	substance.mwt	substance.logp	purchasable	reactive	features	tranche_name
CN(C)c1ccc(/C=[NH+]\CCCN2CC[NH+](CCC/[NH+]=C\c3ccc(N(C)C)cc3)CC2)cc1	ZINC000104197535	569842841	/nfs/dbraw/zinc/84/28/41/569842841.db2.gz	GSRZIKRSUVMNAQ-HONQWNAWSA-N	3	1	462.686	3.754	40	30		JHEBMP
CN(C)c1ccc(/C=[NH+]/CCCN2CC[NH+](CCC/[NH+]=C\c3ccc(N(C)C)cc3)CC2)cc1	ZINC000023477235	556074626	/nfs/dbraw/zinc/07/46/26/556074626.db2.gz	GSRZIKRSUVMNAQ-UEUMJKGWSA-N	3	1	462.686	3.754	40	30		JHEBMP
CN(C)c1ccc(/C=[NH+]/CCC[NH+]2CCN(CCC/[NH+]=C\c3ccc(N(C)C)cc3)CC2)cc1	ZINC000023477235	556074630	/nfs/dbraw/zinc/07/46/30/556074630.db2.gz	GSRZIKRSUVMNAQ-UEUMJKGWSA-N	3	1	462.686	3.754	40	30		JHEBMP
CN(C)c1ccc(/C=[NH+]/CCCN2CC[NH+](CCC/[NH+]=C/c3ccc(N(C)C)cc3)CC2)cc1	ZINC000104197539	569842774	/nfs/dbraw/zinc/84/27/74/569842774.db2.gz	GSRZIKRSUVMNAQ-HCTXVGCHSA-N	3	1	462.686	3.754	40	30		JHEBMP
CN=C(Nc1ccc(C(NC)=[NH+]C)cc1)c1ccc(C(Nc2ccc(C(NC)=[NH+]C)cc2)=[NH+]C)cc1	ZINC000096914695	569743761	/nfs/dbraw/zinc/74/37/61/569743761.db2.gz	DURPMPQUACRQDJ-UHFFFAOYSA-N	3	1	482.636	3.855	40	30		JHEBMP