smiles	zinc_id	prot_id	files.db2	substance.inchikey	net_charge	ph_mod_fk	substance.mwt	substance.logp	purchasable	reactive	features	tranche_name
NC(=[NH2+])CC=NC(=O)c1cc(NC(=O)[C@@H]2CCC(N)=[NH+]2)c[nH]1	ZINC000006091183	560205051	/nfs/dbraw/zinc/20/50/51/560205051.db2.gz	PPWJRIYYHYBQEA-YFQZBADGSA-N	2	0	303.326	-0.557	1	30	in-vitro	DBEFRP
C[C@]12CCC(N=NC(N)=[NH2+])C[C@@]1(O)CC[C@@H]2CN=NC(N)=[NH2+]	ZINC000043335177	183355736	/nfs/dbraw/zinc/35/57/36/183355736.db2.gz	IIMJPONRZVCTFP-PWACVWSESA-N	2	0	308.390	-0.794	1	30		DBEFRP
C[C@]12CCC(N=NC(N)=[NH2+])C[C@@]1(O)CC[C@H]2CN=NC(N)=[NH2+]	ZINC000043335179	183355921	/nfs/dbraw/zinc/35/59/21/183355921.db2.gz	IIMJPONRZVCTFP-NXNOKTMUSA-N	2	0	308.390	-0.794	1	30		DBEFRP
Cn1cc(NC(=O)[C@@H]2CCC(=[NH2+])N2)cc1C(=O)NC=CC(N)=[NH2+]	ZINC000005783620	560203221	/nfs/dbraw/zinc/20/32/21/560203221.db2.gz	TUZMLDPJWIHNOC-SHTSDUMZSA-N	2	0	317.353	-0.547	1	30	in-vitro	DBEFRP
Cn1cc(NC(=O)[C@H]2CCC(=[NH2+])N2)cc1C(=O)NC=CC(N)=[NH2+]	ZINC000005783622	560203158	/nfs/dbraw/zinc/20/31/58/560203158.db2.gz	TUZMLDPJWIHNOC-NINDIBSOSA-N	2	0	317.353	-0.547	1	30	in-vitro	DBEFRP