smiles	zinc_id	prot_id	files.db2	substance.inchikey	net_charge	ph_mod_fk	substance.mwt	substance.logp	purchasable	reactive	features	tranche_name
CC(C)C[N@H+](Cc1cc(C(F)(F)F)ccc1Cl)C1CC[NH2+]CC1	ZINC000036093183	213061829	/nfs/dbraw/zinc/06/18/29/213061829.db2.gz	CTOADRXWRKYLHY-UHFFFAOYSA-N	2	1	348.840	4.569	1	0		EJAFMP
CC(C)C[N@@H+](Cc1cc(C(F)(F)F)ccc1Cl)C1CC[NH2+]CC1	ZINC000036093183	213061832	/nfs/dbraw/zinc/06/18/32/213061832.db2.gz	CTOADRXWRKYLHY-UHFFFAOYSA-N	2	1	348.840	4.569	1	0		EJAFMP
Cc1ccc2c(c1C)C[N@@H+](CCCC[NH+](C)C)C[C@H]2c1ccccc1	ZINC000038156045	213204248	/nfs/dbraw/zinc/20/42/48/213204248.db2.gz	ZIQVUHSXFIVRAX-QHCPKHFHSA-N	2	1	336.523	4.593	1	0		EJAFMP
CCC(CC)C[N@@H+](Cc1ccccc1C(F)(F)F)C1CC[NH2+]CC1	ZINC000036093141	213062104	/nfs/dbraw/zinc/06/21/04/213062104.db2.gz	UZCRUMOKTIFCRO-UHFFFAOYSA-N	2	1	342.449	4.696	1	0		EJAFMP
C[NH2+]CCN(C)c1cc(-c2ccc3ccccc3c2)[nH+]c2ccccc21	ZINC000027310398	202153988	/nfs/dbraw/zinc/15/39/88/202153988.db2.gz	HXIPYNNAMYDENF-UHFFFAOYSA-N	2	1	341.458	4.711	1	0		EJAFMP
Fc1ccc2cc(C[NH+]3CCC([NH2+]Cc4ccccc4)CC3)ccc2c1	ZINC000029123627	202181189	/nfs/dbraw/zinc/18/11/89/202181189.db2.gz	OHGPALNUHJEHDY-UHFFFAOYSA-N	2	1	348.465	4.733	1	0		EJAFMP
CC(C)C[N@H+](Cc1cccc(C(F)(F)F)c1Cl)C1CC[NH2+]CC1	ZINC000036093158	213061611	/nfs/dbraw/zinc/06/16/11/213061611.db2.gz	KBEZGSDJUWFFBK-UHFFFAOYSA-N	2	1	348.840	4.569	1	0		EJAFMP
CC(C)C[N@@H+](Cc1cccc(C(F)(F)F)c1Cl)C1CC[NH2+]CC1	ZINC000036093158	213061613	/nfs/dbraw/zinc/06/16/13/213061613.db2.gz	KBEZGSDJUWFFBK-UHFFFAOYSA-N	2	1	348.840	4.569	1	0		EJAFMP
Cc1ccc2c(c1C)C[N@@H+](CCCC[NH+](C)C)C[C@@H]2c1ccccc1	ZINC000038156044	213203663	/nfs/dbraw/zinc/20/36/63/213203663.db2.gz	ZIQVUHSXFIVRAX-HSZRJFAPSA-N	2	1	336.523	4.593	1	0		EJAFMP