smiles	zinc_id	prot_id	files.db2	substance.inchikey	net_charge	ph_mod_fk	substance.mwt	substance.logp	purchasable	reactive	features	tranche_name
O=C(Nc1c[nH]c(=O)[n-]c1=O)c1cccc(C(=O)Nc2c[nH]c(=O)[n-]c2=O)c1	ZINC000003109386	220604721	/nfs/dbraw/zinc/60/47/21/220604721.db2.gz	WIHXKVWCZJZGTF-UHFFFAOYSA-N	-2	3	384.308	-1.056	40	0		GAABHL
C[C@H](N)C(=O)N[C@@H](CCC(=O)[O-])C(=O)N[C@@H](CC(=O)[O-])C(=O)NCC(=O)[O-]	ZINC000003966198	570353600	/nfs/dbraw/zinc/35/36/00/570353600.db2.gz	HGHOBRRUMWJWCU-FXQIFTODSA-N	-3	3	390.349	-3.157	40	0	investigational	GAABHL
CC(C)[C@H](N)C(=O)NCC(=O)N[C@@H](CO)C(=O)N[C@@H](CCC(=O)[O-])C(=O)[O-]	ZINC000005274107	204123364	/nfs/dbraw/zinc/12/33/64/204123364.db2.gz	KDZIGQIDPXKMBA-AUTRQRHGSA-N	-2	3	390.393	-3.003	40	0		GAABHL
N[C@@H](CCC(=O)[O-])C(=O)N[C@@H](CCC(=O)[O-])C(=O)N[C@@H](CC(=O)[O-])C(=O)[O-]	ZINC000015721871	210163507	/nfs/dbraw/zinc/16/35/07/210163507.db2.gz	NKLRYVLERDYDBI-FXQIFTODSA-N	-4	3	391.333	-2.428	40	0		GAABHL
CC(=O)Nc1c([O-])nc(SCC(=O)Nc2ccccc2C(N)=O)[n-]c1=O	ZINC000104611012	570303093	/nfs/dbraw/zinc/30/30/93/570303093.db2.gz	BAZMCDIQGXZOKY-UHFFFAOYSA-N	-2	3	377.382	-1.026	40	0		GAABHL
O=c1[n-]c(=S)[nH]c([O-])c1C(c1cccnc1)c1c([O-])[nH]c(=S)[n-]c1=O	ZINC000223812019	530091096	/nfs/dbraw/zinc/09/10/96/530091096.db2.gz	FYHWCBKQMDQWSL-UHFFFAOYSA-N	-4	3	377.407	-1.541	40	0		GAABHL
N[C@H]1C=CN([C@@H]2C[C@@H](O)[C@H](CO[P@](=O)([O-])OP(=O)([O-])[O-])O2)C(=O)N1	ZINC000584578391	530109311	/nfs/dbraw/zinc/10/93/11/530109311.db2.gz	KEIGXEFGDSBCEL-CWKFCGSDSA-N	-3	3	389.194	-1.488	40	0		GAABHL
N[C@@H]1C=CN([C@@H]2C[C@@H](O)[C@H](CO[P@](=O)([O-])OP(=O)([O-])[O-])O2)C(=O)N1	ZINC000584578392	530109244	/nfs/dbraw/zinc/10/92/44/530109244.db2.gz	KEIGXEFGDSBCEL-KVPKETBZSA-N	-3	3	389.194	-1.488	40	0		GAABHL