smiles	zinc_id	prot_id	files.db2	substance.inchikey	net_charge	ph_mod_fk	substance.mwt	substance.logp	purchasable	reactive	features	tranche_name
c1ccc(C[C@H]([NH2+]C2CC[NH+](Cc3ccccc3)CC2)c2ccccc2)cc1	ZINC000002498937	570522430	/nfs/dbraw/zinc/52/24/30/570522430.db2.gz	KUPNFLQNVACLQP-SANMLTNESA-N	2	1	370.540	5.225	50	0		FKAAMP
c1ccc(C[C@@H]([NH2+]C2CC[NH+](Cc3ccccc3)CC2)c2ccccc2)cc1	ZINC000002498939	570522466	/nfs/dbraw/zinc/52/24/66/570522466.db2.gz	KUPNFLQNVACLQP-AREMUKBSSA-N	2	1	370.540	5.225	50	0		FKAAMP
c1ccc(C[NH+]2CCC([NH2+]CC(c3ccccc3)c3ccccc3)CC2)cc1	ZINC000004022961	204117991	/nfs/dbraw/zinc/11/79/91/204117991.db2.gz	GDUQSIBJSPBLPG-UHFFFAOYSA-N	2	1	370.540	5.073	50	0		FKAAMP
CC[N@@H+](Cc1ccccc1)C1CC[NH+](Cc2cccc3ccccc32)CC1	ZINC000004553797	207028537	/nfs/dbraw/zinc/02/85/37/207028537.db2.gz	YVQHXFQAESMHRO-UHFFFAOYSA-N	2	1	358.529	5.326	50	0		FKAAMP
CC[N@H+](Cc1ccccc1)C1CC[NH+](Cc2cccc3ccccc32)CC1	ZINC000004553797	207028534	/nfs/dbraw/zinc/02/85/34/207028534.db2.gz	YVQHXFQAESMHRO-UHFFFAOYSA-N	2	1	358.529	5.326	50	0		FKAAMP
c1ccc(C2CCC([NH+]3CCC([N@H+]4CCc5ccccc5C4)CC3)CC2)cc1	ZINC000004744598	570604721	/nfs/dbraw/zinc/60/47/21/570604721.db2.gz	XQEJZONKCRZWJS-UHFFFAOYSA-N	2	1	374.572	5.236	50	0		FKAAMP
c1ccc(C2CCC([NH+]3CCC([N@@H+]4CCc5ccccc5C4)CC3)CC2)cc1	ZINC000004744598	570604718	/nfs/dbraw/zinc/60/47/18/570604718.db2.gz	XQEJZONKCRZWJS-UHFFFAOYSA-N	2	1	374.572	5.236	50	0		FKAAMP
C[N@@H+](Cc1ccccc1)C1CC[NH+](C2CCC(c3ccccc3)CC2)CC1	ZINC000004745613	204160545	/nfs/dbraw/zinc/16/05/45/204160545.db2.gz	SCFDDRIDDNIBEB-UHFFFAOYSA-N	2	1	362.561	5.309	50	0		FKAAMP
c1ccc(CC[N@@H+](Cc2ccccc2)C2CC[NH+](C3CCCC3)CC2)cc1	ZINC000004745637	570604424	/nfs/dbraw/zinc/60/44/24/570604424.db2.gz	GYEARUVEOORDAZ-UHFFFAOYSA-N	2	1	362.561	5.138	50	0		FKAAMP
[NH3+]CC[PH+]1Cc2ccc3ccccc3c2-c2c(ccc3ccccc32)C1	ZINC000043199406	571099784	/nfs/dbraw/zinc/09/97/84/571099784.db2.gz	PXDLCEFIOZLJLW-UHFFFAOYSA-N	2	1	355.421	6.114	50	0		FKAAMP
Fc1ccc([C@@H]2CCCC[N@H+]2Cc2cc(C[NH+]3CCCC3)cs2)cc1	ZINC000670468970	571359363	/nfs/dbraw/zinc/35/93/63/571359363.db2.gz	YNKIQCUKOBVQTA-NRFANRHFSA-N	2	1	358.526	5.210	50	0		FKAAMP
Fc1ccc([C@H]2CCCC[N@H+]2Cc2cc(C[NH+]3CCCC3)cs2)cc1	ZINC000670468971	571359394	/nfs/dbraw/zinc/35/93/94/571359394.db2.gz	YNKIQCUKOBVQTA-OAQYLSRUSA-N	2	1	358.526	5.210	50	0		FKAAMP