smiles	zinc_id	prot_id	files.db2	substance.inchikey	net_charge	ph_mod_fk	substance.mwt	substance.logp	purchasable	reactive	features	tranche_name
C[C@H](N)C(=O)N[C@@H](C)C(=O)N[C@@H](C)C(=O)N[C@@H](Cc1ccc(O)cc1)C(=O)N[C@@H](C)C(=O)[O-]	ZINC000015721824	555956183	/nfs/dbraw/zinc/95/61/83/555956183.db2.gz	WOZKTYLXSGYCMF-YTORKDELSA-N	-1	3	465.507	-1.635	10	0		JAAEHM
C[C@H](NC(=O)[C@H](N)CC(=O)[O-])C(=O)N[C@@H](Cc1cnc[nH]1)C(=O)N[C@@H](CCCC[NH3+])C(=O)[O-]	ZINC000034211768	569639793	/nfs/dbraw/zinc/63/97/93/569639793.db2.gz	LNDPHUOSLCCHHY-GHYVTOPFSA-N	-1	3	469.499	-2.558	10	0		JAAEHM
C[C@H](NC(=O)[C@H](N)CC(=O)[O-])C(=O)N[C@@H](Cc1c[nH]cn1)C(=O)N[C@@H](CCCC[NH3+])C(=O)[O-]	ZINC000034211768	569639791	/nfs/dbraw/zinc/63/97/91/569639791.db2.gz	LNDPHUOSLCCHHY-GHYVTOPFSA-N	-1	3	469.499	-2.558	10	0		JAAEHM
C[C@H](NC(=O)[C@H](N)CC(=O)[O-])C(=O)N[C@H](Cc1cnc[nH]1)C(=O)N[C@@H](CCCC[NH3+])C(=O)[O-]	ZINC000034211770	569639834	/nfs/dbraw/zinc/63/98/34/569639834.db2.gz	LNDPHUOSLCCHHY-AHLTXXRQSA-N	-1	3	469.499	-2.558	10	0		JAAEHM
C[C@H](NC(=O)[C@H](N)CC(=O)[O-])C(=O)N[C@H](Cc1c[nH]cn1)C(=O)N[C@@H](CCCC[NH3+])C(=O)[O-]	ZINC000034211770	569639832	/nfs/dbraw/zinc/63/98/32/569639832.db2.gz	LNDPHUOSLCCHHY-AHLTXXRQSA-N	-1	3	469.499	-2.558	10	0		JAAEHM
CC(C)[C@H](N)C(=O)N[C@H](CCC(=O)N[C@H](CCCNC(N)=[NH2+])C(=O)NCC(=O)[O-])C(=O)[O-]	ZINC000071788352	569698388	/nfs/dbraw/zinc/69/83/88/569698388.db2.gz	LTKLLKUVWGIOLS-GYSYKLTISA-N	-1	3	459.504	-2.732	10	0		JAAEHM
CN1CC[C@@]23c4c5c(O[C@@H]6O[C@H](C(=O)[O-])[C@@H](O)[C@H](O)[C@H]6O)ccc4C[C@@H]1[C@]2(O)CC[C@@H](O)[C@@H]3O5	ZINC000077300766	569705792	/nfs/dbraw/zinc/70/57/92/569705792.db2.gz	IJMSQWNXMRYVBK-GJHYNJRRSA-N	-1	3	479.482	-1.898	10	0	in-vitro	JAAEHM