smiles	zinc_id	prot_id	files.db2	substance.inchikey	net_charge	ph_mod_fk	substance.mwt	substance.logp	purchasable	reactive	features	tranche_name
COc1ccc(C[NH2+]C2(c3ccccc3OC)CCCC2)cc1C[NH+]1CCOCC1	ZINC000012292855	558365891	/nfs/dbraw/zinc/36/58/91/558365891.db2.gz	LGJUDOUVVGUVIE-UHFFFAOYSA-N	2	2	410.558	4.095	40	10		HICBLP
COc1ccc(C2([NH2+]Cc3ccc(OC)c(C[NH+]4CCOCC4)c3)CCCC2)cc1	ZINC000012292858	558365979	/nfs/dbraw/zinc/36/59/79/558365979.db2.gz	SAJUSEVPKVVQAF-UHFFFAOYSA-N	2	2	410.558	4.095	40	10		HICBLP
CNc1cc(C[N@H+](C)Cc2ccc3c(c2)CCCN3C(C)C)nc([C@H]2CCCC[NH2+]2)n1	ZINC000257303532	568805513	/nfs/dbraw/zinc/80/55/13/568805513.db2.gz	SHPJKMLELZVSQP-JOCHJYFZSA-N	2	2	422.621	4.126	40	10		HICBLP
CNc1cc(C[N@@H+](C)Cc2ccc3c(c2)CCCN3C(C)C)nc([C@H]2CCCC[NH2+]2)n1	ZINC000257303532	568805514	/nfs/dbraw/zinc/80/55/14/568805514.db2.gz	SHPJKMLELZVSQP-JOCHJYFZSA-N	2	2	422.621	4.126	40	10		HICBLP
COc1ccc(C[N@H+](CCCn2cc[nH+]c2)Cc2ccc3c(c2)CCCN3C)cc1	ZINC000036740175	558801709	/nfs/dbraw/zinc/80/17/09/558801709.db2.gz	HIVIMKUGXUZRJO-UHFFFAOYSA-N	2	2	404.558	4.367	40	10		HICBLP
COc1ccc(C[N@@H+](CCCn2cc[nH+]c2)Cc2ccc3c(c2)CCCN3C)cc1	ZINC000036740175	558801712	/nfs/dbraw/zinc/80/17/12/558801712.db2.gz	HIVIMKUGXUZRJO-UHFFFAOYSA-N	2	2	404.558	4.367	40	10		HICBLP
Cc1nc2sccn2c1C[N@@H+](CCCn1cc[nH+]c1)Cc1ccc(N(C)C)cc1	ZINC000043277736	527210596	/nfs/dbraw/zinc/21/05/96/527210596.db2.gz	PUJBDCOWOKTNKA-UHFFFAOYSA-N	2	2	408.575	4.059	40	10		HICBLP
Cc1nc2sccn2c1C[N@H+](CCCn1cc[nH+]c1)Cc1ccc(N(C)C)cc1	ZINC000043277736	527210603	/nfs/dbraw/zinc/21/06/03/527210603.db2.gz	PUJBDCOWOKTNKA-UHFFFAOYSA-N	2	2	408.575	4.059	40	10		HICBLP
CNc1cc(C[N@H+](C)Cc2ccc3c(c2)CCCN3C(C)C)nc([C@@H]2CCCC[NH2+]2)n1	ZINC000019709934	569348135	/nfs/dbraw/zinc/34/81/35/569348135.db2.gz	SHPJKMLELZVSQP-QFIPXVFZSA-N	2	2	422.621	4.126	40	10		HICBLP
CNc1cc(C[N@@H+](C)Cc2ccc3c(c2)CCCN3C(C)C)nc([C@@H]2CCCC[NH2+]2)n1	ZINC000019709934	569348136	/nfs/dbraw/zinc/34/81/36/569348136.db2.gz	SHPJKMLELZVSQP-QFIPXVFZSA-N	2	2	422.621	4.126	40	10		HICBLP