smiles	zinc_id	prot_id	files.db2	substance.inchikey	net_charge	ph_mod_fk	substance.mwt	substance.logp	purchasable	reactive	features	tranche_name
CC(=O)N1CCC2(CC1)OC(=O)C(C)=C2C(=O)NCCC[NH+]1CCN(C)CC1	ZINC000020531847	210343694	/nfs/dbraw/zinc/34/36/94/210343694.db2.gz	INBZBWOUCWZQFQ-UHFFFAOYSA-N	1	1	392.500	-0.006	1	0		GBAFMO
CCc1cc(N2CCC([NH2+][C@@H]3CS(=O)(=O)C[C@H]3O)CC2)nc(N(C)C)n1	ZINC000095505494	136180076	/nfs/dbraw/zinc/18/00/76/136180076.db2.gz	ZJKBMLNSLUDREG-HUUCEWRRSA-N	1	1	383.518	-0.179	1	0		GBAFMO
NCC(=O)Nc1cncc(-c2nn3c(nc(N4CC[NH2+]CC4)cc3=O)s2)c1	ZINC000103269095	136191062	/nfs/dbraw/zinc/19/10/62/136191062.db2.gz	LTVKZVGAALCRFW-UHFFFAOYSA-N	1	1	386.441	-0.480	1	0		GBAFMO
NCC(=O)Nc1cc(-c2nn3c(nc(N4CC[NH2+]CC4)cc3=O)s2)ccn1	ZINC000103269097	136191039	/nfs/dbraw/zinc/19/10/39/136191039.db2.gz	YTFMOSCBEAMELI-UHFFFAOYSA-N	1	1	386.441	-0.480	1	0		GBAFMO