smiles	zinc_id	prot_id	files.db2	substance.inchikey	net_charge	ph_mod_fk	substance.mwt	substance.logp	purchasable	reactive	features	tranche_name
Cc1ccc2n(C)c(-c3ccc(C=NNC4=[NH+]CCCN4)cc3)c[n+]2c1	ZINC000026835194	202149008	/nfs/dbraw/zinc/14/90/08/202149008.db2.gz	PAGBNLZOAKQCRE-FSJBWODESA-N	2	2	347.446	2.012	1	30		EEEFLP
C#Cc1cccc(Nc2ncnn3ccc(C[NH+]4CCC([NH3+])CC4)c23)c1	ZINC000066252028	215026311	/nfs/dbraw/zinc/02/63/11/215026311.db2.gz	RKUHGVDFHLNNLT-UHFFFAOYSA-N	2	2	346.438	2.377	1	30		EEEFLP
Cc1cc[n+]2cc(-c3ccc(C=NNC4=[NH+]CCCN4)cc3)n(C)c2c1	ZINC000026830250	212536000	/nfs/dbraw/zinc/53/60/00/212536000.db2.gz	CDFLYVBMPYARQF-YDZHTSKRSA-N	2	2	347.446	2.012	1	30		EEEFLP
CC[C@H](C)[C@H]([NH2+]C[C@@H]([NH3+])CS)C(=O)NCc1ccc(C)cc1C	ZINC000027315782	202154062	/nfs/dbraw/zinc/15/40/62/202154062.db2.gz	ZBVDGGZJTGDHST-XKQJLSEDSA-N	2	2	337.533	2.181	1	30		EEEFLP
O=C(/C=C/c1ccc(C[NH2+]CCc2c[nH+]c3ccccn23)cc1)NO	ZINC000072114284	216011316	/nfs/dbraw/zinc/01/13/16/216011316.db2.gz	UNPUPHZKXHNIRL-CMDGGOBGSA-N	2	2	336.395	2.185	1	30		EEEFLP
CC[C@@H](C)[C@H]([NH2+]C[C@@H]([NH3+])CS)C(=O)NCc1ccc(C)cc1C	ZINC000038311863	213207113	/nfs/dbraw/zinc/20/71/13/213207113.db2.gz	ZBVDGGZJTGDHST-XYPHTWIQSA-N	2	2	337.533	2.181	1	30		EEEFLP