smiles	zinc_id	prot_id	files.db2	substance.inchikey	net_charge	ph_mod_fk	substance.mwt	substance.logp	purchasable	reactive	features	tranche_name
CC(C)=CCC/C(C)=C(\F)CO[P@](=O)([O-])O[P@@](=O)([O-])O	ZINC000013539354	560218967	/nfs/dbraw/zinc/21/89/67/560218967.db2.gz	BYJNSLXDWGDGAC-KTKRTIGZSA-N	-2	1	332.201	3.203	1	0	in-vitro	EGAFML
CC(C)=CCC/C(C)=C(\F)CO[P@](=O)([O-])O[P@](=O)([O-])O	ZINC000013539354	560218969	/nfs/dbraw/zinc/21/89/69/560218969.db2.gz	BYJNSLXDWGDGAC-KTKRTIGZSA-N	-2	1	332.201	3.203	1	0	in-vitro	EGAFML
CC(C)OP(=O)([O-])C(Cl)(Cl)[P@@](=O)([O-])OC(C)C	ZINC000026404395	202142707	/nfs/dbraw/zinc/14/27/07/202142707.db2.gz	SAOXZPMFJMHTDO-UHFFFAOYSA-N	-2	1	329.053	3.296	1	0		EGAFML
CCCCCCO[P@](=O)([O-])C(Cl)(Cl)P(=O)([O-])[O-]	ZINC000026392857	202143128	/nfs/dbraw/zinc/14/31/28/202143128.db2.gz	IPURVIXSXJUNHF-UHFFFAOYSA-N	-3	1	329.053	3.035	1	0		EGAFML
CCCCCCO[P@@](=O)([O-])C(Cl)(Cl)P(=O)([O-])O	ZINC000026392857	202143129	/nfs/dbraw/zinc/14/31/29/202143129.db2.gz	IPURVIXSXJUNHF-UHFFFAOYSA-N	-2	1	329.053	3.035	1	0		EGAFML
CCCCCCO[P@](=O)([O-])C(Cl)(Cl)P(=O)([O-])O	ZINC000026392857	202143133	/nfs/dbraw/zinc/14/31/33/202143133.db2.gz	IPURVIXSXJUNHF-UHFFFAOYSA-N	-2	1	329.053	3.035	1	0		EGAFML
CCCCCCOP(=O)([O-])C(Cl)(Cl)[P@@](=O)([O-])O	ZINC000026392857	202143137	/nfs/dbraw/zinc/14/31/37/202143137.db2.gz	IPURVIXSXJUNHF-UHFFFAOYSA-N	-2	1	329.053	3.035	1	0		EGAFML
CCCCCCOP(=O)([O-])C(Cl)(Cl)[P@](=O)([O-])O	ZINC000026392857	202143140	/nfs/dbraw/zinc/14/31/40/202143140.db2.gz	IPURVIXSXJUNHF-UHFFFAOYSA-N	-2	1	329.053	3.035	1	0		EGAFML
O=C([O-])CN(C(=O)c1ccccc1[O-])c1cc(Cl)cc(Cl)c1	ZINC000040873503	202466820	/nfs/dbraw/zinc/46/68/20/202466820.db2.gz	DACIPZZDIBGJCJ-UHFFFAOYSA-N	-2	1	340.162	3.430	1	0		EGAFML
Cc1cc(Cc2c(C)cc(OCP(=O)([O-])[O-])cc2C)ccc1O	ZINC000040422758	213301301	/nfs/dbraw/zinc/30/13/01/213301301.db2.gz	OYZZBRHSILKBDZ-UHFFFAOYSA-N	-2	1	336.324	3.422	1	0		EGAFML
CC(C)=CCC/C(C)=C(/F)CO[P@](=O)([O-])O[P@@](=O)([O-])O	ZINC000013539357	560219051	/nfs/dbraw/zinc/21/90/51/560219051.db2.gz	BYJNSLXDWGDGAC-MDZDMXLPSA-N	-2	1	332.201	3.203	1	0	in-vitro	EGAFML
CC(C)=CCC/C(C)=C(/F)CO[P@](=O)([O-])O[P@](=O)([O-])O	ZINC000013539357	560219052	/nfs/dbraw/zinc/21/90/52/560219052.db2.gz	BYJNSLXDWGDGAC-MDZDMXLPSA-N	-2	1	332.201	3.203	1	0	in-vitro	EGAFML