smiles	zinc_id	prot_id	files.db2	substance.inchikey	net_charge	ph_mod_fk	substance.mwt	substance.logp	purchasable	reactive	features	tranche_name
CN1CC[NH+]([C@@H]2C[C@H]3[C@@H]4CC[C@@H]5C[C@@H](O)[C@H]([NH+]6CCN(C)CC6)C[C@]5(C)[C@H]4CC[C@]3(C)[C@@H]2O)CC1	ZINC000229834272	570041299	/nfs/dbraw/zinc/04/12/99/570041299.db2.gz	RKCQYHLOQCFYLT-NDZLXBRZSA-N	2	0	488.761	2.203	10	0		JEAERP
CN1CC[NH+]([C@H]2C[C@H]3[C@@H]4CC[C@H]5C[C@@H](O)[C@H]([NH+]6CCN(C)CC6)C[C@]5(C)[C@H]4CC[C@]3(C)[C@@H]2O)CC1	ZINC000229834301	570041489	/nfs/dbraw/zinc/04/14/89/570041489.db2.gz	RKCQYHLOQCFYLT-UXFHGCHUSA-N	2	0	488.761	2.203	10	0		JEAERP
CN1CC[NH+]([C@@H]2C[C@H]3[C@@H]4CC[C@H]5C[C@@H](O)[C@H]([NH+]6CCN(C)CC6)C[C@]5(C)[C@H]4CC[C@]3(C)[C@@H]2O)CC1	ZINC000229834293	570041434	/nfs/dbraw/zinc/04/14/34/570041434.db2.gz	RKCQYHLOQCFYLT-YSZDTMSKSA-N	2	0	488.761	2.203	10	0		JEAERP
CN1CC[NH+]([C@H]2C[C@H]3[C@@H]4CC[C@@H]5C[C@@H](O)[C@H]([NH+]6CCN(C)CC6)C[C@]5(C)[C@H]4CC[C@]3(C)[C@@H]2O)CC1	ZINC000229834287	570041470	/nfs/dbraw/zinc/04/14/70/570041470.db2.gz	RKCQYHLOQCFYLT-RIPDCPQFSA-N	2	0	488.761	2.203	10	0		JEAERP
O=C(CCN(C1CC[NH+](Cc2ccccc2)CC1)S(=O)(=O)c1ccccc1)N1CC[NH2+]CC1	ZINC000015862692	556035803	/nfs/dbraw/zinc/03/58/03/556035803.db2.gz	VLIGNDWCPLZFTA-UHFFFAOYSA-N	2	0	470.639	2.164	10	0		JEAERP
CC[NH+]1CCN(CCCNC(=O)c2cnn(-c3ccc(F)cc3F)c2C2CC[NH2+]CC2)CC1	ZINC000020941017	195255665	/nfs/dbraw/zinc/25/56/65/195255665.db2.gz	AAGGBRCZBAUZLQ-UHFFFAOYSA-N	2	0	460.573	2.375	10	0		JEAERP