smiles	zinc_id	prot_id	files.db2	substance.inchikey	net_charge	ph_mod_fk	substance.mwt	substance.logp	purchasable	reactive	features	tranche_name
N[C@@H](CCCC[NH3+])C(=O)N[C@H](CCCC[NH3+])C(=O)N[C@@H](CCCC[NH3+])C(=O)N[C@@H](CCCC[NH3+])C(=O)[O-]	ZINC000004556787	552467187	/nfs/dbraw/zinc/46/71/87/552467187.db2.gz	RRBGTUQJDFBWNN-YRPNKDGESA-N	3	3	530.715	-1.631	50	0		KAAAHP
NC(=O)NC=C1NC(=O)[C@H](CNC(=O)[C@@H](N)CCC[NH3+])NC(=O)[C@H](CO)NC(=O)[C@@H](N)CNC(=O)[C@H]([C@@H]2CC[NH+]=C(N)N2)NC1=O	ZINC000169724075	571559539	/nfs/dbraw/zinc/55/95/39/571559539.db2.gz	WBHNJMLZXVGDMO-FVVNTBNHSA-N	2	3	654.690	-8.415	50	0		KAAAHP
NC(=O)NC=C1NC(=O)[C@H](CNC(=O)[C@@H](N)CCC[NH3+])NC(=O)[C@H](CO)NC(=O)[C@@H](N)CNC(=O)[C@H]([C@H]2CC[NH+]=C(N)N2)NC1=O	ZINC000169724076	571559546	/nfs/dbraw/zinc/55/95/46/571559546.db2.gz	WBHNJMLZXVGDMO-VAHAYXKRSA-N	2	3	654.690	-8.415	50	0		KAAAHP
NC(=O)NC=C1NC(=O)[C@@H](CNC(=O)[C@@H](N)CCC[NH3+])NC(=O)[C@H](CO)NC(=O)[C@H](N)CNC(=O)[C@H]([C@@H]2CC[NH+]=C(N)N2)NC1=O	ZINC000169730770	571559697	/nfs/dbraw/zinc/55/96/97/571559697.db2.gz	WBHNJMLZXVGDMO-NZNBWOFFSA-N	2	3	654.690	-8.415	50	0	in-vitro	KAAAHP
NC(=O)NC=C1NC(=O)[C@@H](CNC(=O)[C@@H](N)CCC[NH3+])NC(=O)[C@H](CO)NC(=O)[C@H](N)CNC(=O)[C@H]([C@H]2CC[NH+]=C(N)N2)NC1=O	ZINC000169730771	571559661	/nfs/dbraw/zinc/55/96/61/571559661.db2.gz	WBHNJMLZXVGDMO-FZPZTNHFSA-N	2	3	654.690	-8.415	50	0	in-vitro	KAAAHP
N[C@@H](CCCC[NH3+])C(=O)N[C@H](CCCC[NH3+])C(=O)N[C@H](CCCC[NH3+])C(=O)N[C@H](CCCC[NH3+])C(=O)[O-]	ZINC000257373231	572322326	/nfs/dbraw/zinc/32/23/26/572322326.db2.gz	RRBGTUQJDFBWNN-MTQWCTHYSA-N	3	3	530.715	-1.631	50	0		KAAAHP
N[C@@H](CCCC[NH3+])C(=O)N[C@H](CCCC[NH3+])C(=O)N[C@H](CCCC[NH3+])C(=O)N[C@@H](CCCC[NH3+])C(=O)[O-]	ZINC000257373232	572322315	/nfs/dbraw/zinc/32/23/15/572322315.db2.gz	RRBGTUQJDFBWNN-NMLBUPMWSA-N	3	3	530.715	-1.631	50	0		KAAAHP
N[C@@H](CCCC[NH3+])C(=O)N[C@H](CCCC[NH3+])C(=O)N[C@@H](CCCC[NH3+])C(=O)N[C@H](CCCC[NH3+])C(=O)[O-]	ZINC000257373233	572322331	/nfs/dbraw/zinc/32/23/31/572322331.db2.gz	RRBGTUQJDFBWNN-ZGXWSNOMSA-N	3	3	530.715	-1.631	50	0		KAAAHP