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](NC(=O)C1=NNC(=O)C1)C(=O)[O-]	738223295	582662679	/nfs/dbraw/zinc/66/26/79/582662679.db2.gz	RVUIIFCQQWOLMF-VKHMYHEASA-N	-1	2	199.166	-1.548	20	0		AAADLM
CCONC(=O)CNC(=O)C(=O)[O-]	844272404	583140096	/nfs/dbraw/zinc/14/00/96/583140096.db2.gz	WLOOEWZKMYMVBC-UHFFFAOYSA-N	-1	2	190.155	-1.745	20	0		AAADLM
CN(CCO)C(=O)COCC(=O)[O-]	41042249	167879620	/nfs/dbraw/zinc/87/96/20/167879620.db2.gz	QEBYTZDUNWCUEH-UHFFFAOYSA-N	-1	2	191.183	-1.462	20	0		AAADLM
CNc1nc([O-])c(F)c(=O)[nH]1	157685704	344111676	/nfs/dbraw/zinc/11/16/76/344111676.db2.gz	HDBMBTRENWBKPY-UHFFFAOYSA-N	-1	2	159.120	-1.444	20	0		AAADLM
Nc1nccc([P@@](=O)([O-])O)n1	238699700	351824595	/nfs/dbraw/zinc/82/45/95/351824595.db2.gz	GVDPFALIUBQQIM-UHFFFAOYSA-N	-1	2	175.084	-1.138	20	0		AAADLM
Nc1nccc([P@](=O)([O-])O)n1	238699700	351824596	/nfs/dbraw/zinc/82/45/96/351824596.db2.gz	GVDPFALIUBQQIM-UHFFFAOYSA-N	-1	2	175.084	-1.138	20	0		AAADLM
COCCONC(=O)CNC(=O)[O-]	829008201	604086135	/nfs/dbraw/zinc/08/61/35/604086135.db2.gz	WBPHHSZZSNSZIO-UHFFFAOYSA-N	-1	2	192.171	-1.052	20	0		AAADLM
CN(CC(=O)[O-])C(=O)C1=NNC(=O)C1	737974056	573830898	/nfs/dbraw/zinc/83/08/98/573830898.db2.gz	FWDHESHQONMVBG-UHFFFAOYSA-N	-1	2	199.166	-1.595	20	0		AAADLM
O=C([O-])C(=O)NCc1n[nH]c(=O)[nH]1	307412390	757091360	/nfs/dbraw/zinc/09/13/60/757091360.db2.gz	RDLFGISFUGGAJJ-UHFFFAOYSA-N	-1	2	186.127	-2.201	20	0		AAADLM