smiles	zinc_id	prot_id	files.db2	substance.inchikey	net_charge	ph_mod_fk	substance.mwt	substance.logp	purchasable	reactive	features	tranche_name
CCCCCNC(P(=O)([O-])O)[P@@](=O)([O-])O	ZINC000005973217	170164369	/nfs/dbraw/zinc/16/43/69/170164369.db2.gz	FQXJJCSAFHONGH-UHFFFAOYSA-N	-2	2	261.151	0.405	10	0		CCAELL
CCCCCNC(P(=O)([O-])O)[P@](=O)([O-])O	ZINC000005973217	170164371	/nfs/dbraw/zinc/16/43/71/170164371.db2.gz	FQXJJCSAFHONGH-UHFFFAOYSA-N	-2	2	261.151	0.405	10	0		CCAELL
Cc1ncc(CO[P@@](=O)([O-])O)c(C(=O)[O-])c1O	ZINC000013542713	388787597	/nfs/dbraw/zinc/78/75/97/388787597.db2.gz	FTQNPJLEFOEFIU-UHFFFAOYSA-N	-2	2	263.142	0.403	10	0		CCAELL
Cc1ncc(CO[P@](=O)([O-])O)c(C(=O)[O-])c1O	ZINC000013542713	388787601	/nfs/dbraw/zinc/78/76/01/388787601.db2.gz	FTQNPJLEFOEFIU-UHFFFAOYSA-N	-2	2	263.142	0.403	10	0		CCAELL
CCCCCCNC(P(=O)([O-])O)[P@@](=O)([O-])O	ZINC000013473666	581096949	/nfs/dbraw/zinc/09/69/49/581096949.db2.gz	UXLZYKHQCOQILT-UHFFFAOYSA-N	-2	2	275.178	0.795	10	0		CCAELL
CCCCCCNC(P(=O)([O-])O)[P@](=O)([O-])O	ZINC000013473666	581096950	/nfs/dbraw/zinc/09/69/50/581096950.db2.gz	UXLZYKHQCOQILT-UHFFFAOYSA-N	-2	2	275.178	0.795	10	0		CCAELL
O=P([O-])(O)C(NCCc1ccccc1)[P@](=O)([O-])O	ZINC000058547890	348628985	/nfs/dbraw/zinc/62/89/85/348628985.db2.gz	GVGKHJBNMNGYDB-UHFFFAOYSA-N	-2	2	295.168	0.458	10	0		CCAELL
O=P([O-])(O)C(NCCc1ccccc1)[P@@](=O)([O-])O	ZINC000058547890	348628989	/nfs/dbraw/zinc/62/89/89/348628989.db2.gz	GVGKHJBNMNGYDB-UHFFFAOYSA-N	-2	2	295.168	0.458	10	0		CCAELL
O=P([O-])(O)C(Cc1ccccc1)[P@](=O)([O-])O	ZINC000003650187	347985440	/nfs/dbraw/zinc/98/54/40/347985440.db2.gz	LKGJFSBVIBNBPW-UHFFFAOYSA-N	-2	2	266.126	0.911	10	0		CCAELL
O=P([O-])(O)C(Cc1ccccc1)[P@@](=O)([O-])O	ZINC000003650187	347985444	/nfs/dbraw/zinc/98/54/44/347985444.db2.gz	LKGJFSBVIBNBPW-UHFFFAOYSA-N	-2	2	266.126	0.911	10	0		CCAELL
CCCCCCC(O)(P(=O)([O-])O)[P@@](=O)([O-])O	ZINC000024951879	581096883	/nfs/dbraw/zinc/09/68/83/581096883.db2.gz	IJEGNOYPWRBKAE-UHFFFAOYSA-N	-2	2	276.162	0.958	10	0	in-vivo	CCAELL
CCCCCCC(O)(P(=O)([O-])O)[P@](=O)([O-])O	ZINC000024951879	581096884	/nfs/dbraw/zinc/09/68/84/581096884.db2.gz	IJEGNOYPWRBKAE-UHFFFAOYSA-N	-2	2	276.162	0.958	10	0	in-vivo	CCAELL
Cc1cc(C)cc(C(O)(P(=O)([O-])O)[P@@](=O)([O-])O)c1	ZINC000205758832	389129966	/nfs/dbraw/zinc/12/99/66/389129966.db2.gz	FSFRLBOPCTVGAM-UHFFFAOYSA-N	-2	2	296.152	0.761	10	0		CCAELL
Cc1cc(C)cc(C(O)(P(=O)([O-])O)[P@](=O)([O-])O)c1	ZINC000205758832	389129969	/nfs/dbraw/zinc/12/99/69/389129969.db2.gz	FSFRLBOPCTVGAM-UHFFFAOYSA-N	-2	2	296.152	0.761	10	0		CCAELL
O=P([O-])(O)C(CNc1ccccc1)[P@](=O)([O-])O	ZINC000096923787	185130875	/nfs/dbraw/zinc/13/08/75/185130875.db2.gz	FPDLBFDOXAQQPI-UHFFFAOYSA-N	-2	2	281.141	0.780	10	0		CCAELL
O=P([O-])(O)C(CNc1ccccc1)[P@@](=O)([O-])O	ZINC000096923787	185130876	/nfs/dbraw/zinc/13/08/76/185130876.db2.gz	FPDLBFDOXAQQPI-UHFFFAOYSA-N	-2	2	281.141	0.780	10	0		CCAELL
O=C([O-])C[NH+](CC(=O)[O-])[C@@H](Cc1ccccc1)C(=O)[O-]	ZINC000005603573	170118632	/nfs/dbraw/zinc/11/86/32/170118632.db2.gz	HWXFTWCFFAXRMQ-JTQLQIEISA-N	-2	2	281.264	0.154	10	0		CCAELL
O=P([O-])(O)CN(Cc1ccccc1)C[P@](=O)([O-])O	ZINC000003175631	347979048	/nfs/dbraw/zinc/97/90/48/347979048.db2.gz	OWIOSXILXLIEGX-UHFFFAOYSA-N	-2	2	295.168	0.759	10	0		CCAELL
O=P([O-])(O)CN(Cc1ccccc1)C[P@@](=O)([O-])O	ZINC000003175631	347979055	/nfs/dbraw/zinc/97/90/55/347979055.db2.gz	OWIOSXILXLIEGX-UHFFFAOYSA-N	-2	2	295.168	0.759	10	0		CCAELL
O=C([O-])C1=NN(Cc2ccc(S(=O)(=O)[O-])cc2)C(=O)C1	ZINC000033606155	171814430	/nfs/dbraw/zinc/81/44/30/171814430.db2.gz	JVQOIEZICVLIPO-UHFFFAOYSA-N	-2	2	298.276	0.106	10	0		CCAELL
O=P([O-])(O)C(Nc1ccccc1)[P@](=O)([O-])O	ZINC000005939052	170158989	/nfs/dbraw/zinc/15/89/89/170158989.db2.gz	XVNZXEWQQDCZSM-UHFFFAOYSA-N	-2	2	267.114	0.738	10	0		CCAELL
O=P([O-])(O)C(Nc1ccccc1)[P@@](=O)([O-])O	ZINC000005939052	170158990	/nfs/dbraw/zinc/15/89/90/170158990.db2.gz	XVNZXEWQQDCZSM-UHFFFAOYSA-N	-2	2	267.114	0.738	10	0		CCAELL
CCCCCN(CP(=O)([O-])O)C[P@@](=O)([O-])O	ZINC000072414998	348922624	/nfs/dbraw/zinc/92/26/24/348922624.db2.gz	OJMJRKCRLZJZOG-UHFFFAOYSA-N	-2	2	275.178	0.749	10	0		CCAELL
CCCCCN(CP(=O)([O-])O)C[P@](=O)([O-])O	ZINC000072414998	348922627	/nfs/dbraw/zinc/92/26/27/348922627.db2.gz	OJMJRKCRLZJZOG-UHFFFAOYSA-N	-2	2	275.178	0.749	10	0		CCAELL
O=P([O-])(O)C(NCc1ccccc1)[P@](=O)([O-])O	ZINC000103222202	349692643	/nfs/dbraw/zinc/69/26/43/349692643.db2.gz	VFUPNPFGBGLUSA-UHFFFAOYSA-N	-4	2	281.141	0.415	10	0		CCAELL
O=P([O-])(O)C(NCc1ccccc1)[P@@](=O)([O-])O	ZINC000103222202	349692649	/nfs/dbraw/zinc/69/26/49/349692649.db2.gz	VFUPNPFGBGLUSA-UHFFFAOYSA-N	-2	2	281.141	0.415	10	0		CCAELL