smiles	zinc_id	prot_id	files.db2	substance.inchikey	net_charge	ph_mod_fk	substance.mwt	substance.logp	purchasable	reactive	features	tranche_name
CC[NH+](CC)CCCCCCNc1cc[nH+]c2cc(Cl)ccc12	ZINC000001555296	563391707	/nfs/dbraw/zinc/39/17/07/563391707.db2.gz	NDMIXVHHIRTEFY-UHFFFAOYSA-N	2	1	333.907	5.202	40	0		EKABMP
CC[NH+](CC)CCC[C@@H](C)Nc1cc(C)c2[nH+]c(C)cc(C)c2c1C	ZINC000001563142	563392117	/nfs/dbraw/zinc/39/21/17/563392117.db2.gz	CWVBWYLYLRXCIV-QGZVFWFLSA-N	2	1	341.543	5.391	40	0		EKABMP
Clc1ccc2c(NC3CCC([NH+]4CCCCC4)CC3)cc[nH+]c2c1	ZINC000001687514	563403962	/nfs/dbraw/zinc/40/39/62/563403962.db2.gz	SVJCZPVZDHLIEP-UHFFFAOYSA-N	2	1	343.902	5.097	40	0	in-vitro	EKABMP
CC[NH+](CC)CCCC[C@H](C)Nc1cc[nH+]c2cc(Cl)ccc12	ZINC000001729626	563407858	/nfs/dbraw/zinc/40/78/58/563407858.db2.gz	MXGGYCYYCOWYGB-HNNXBMFYSA-N	2	1	333.907	5.201	40	0		EKABMP
CC[NH+](CC)CCCC[C@@H](C)Nc1cc[nH+]c2cc(Cl)ccc12	ZINC000002042668	563419074	/nfs/dbraw/zinc/41/90/74/563419074.db2.gz	MXGGYCYYCOWYGB-OAHLLOKOSA-N	2	1	333.907	5.201	40	0		EKABMP
CC[NH+](CC)CCCCCC[N@@H+](CC)Cc1cc2ccccc2o1	ZINC000004713686	210256865	/nfs/dbraw/zinc/25/68/65/210256865.db2.gz	PCUJZPANFXVLDW-UHFFFAOYSA-N	2	1	330.516	5.157	40	0		EKABMP
CC[NH+](CC)CCC[C@H](C)Nc1cc(C)c2[nH+]c(C)cc(C)c2c1C	ZINC000005839637	563551922	/nfs/dbraw/zinc/55/19/22/563551922.db2.gz	CWVBWYLYLRXCIV-KRWDZBQOSA-N	2	1	341.543	5.391	40	0		EKABMP