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)(C)Cc1sc(N)nc1-c1ccc([P@@](=O)([O-])O)o1	ZINC000066113400	184390591	/nfs/dbraw/zinc/39/05/91/184390591.db2.gz	DZIHZGSPDNFJBW-UHFFFAOYSA-N	-1	2	316.319	2.377	1	0		DEAFLM
CC(C)(C)Cc1sc(N)nc1-c1ccc([P@](=O)([O-])O)o1	ZINC000066113400	184390593	/nfs/dbraw/zinc/39/05/93/184390593.db2.gz	DZIHZGSPDNFJBW-UHFFFAOYSA-N	-1	2	316.319	2.377	1	0		DEAFLM
CCn1cc(C(=O)[O-])c(=O)c2cc(Cl)c(N3CCCC3)nc21	ZINC000026752304	182452488	/nfs/dbraw/zinc/45/24/88/182452488.db2.gz	LVZSNQPBPUONNY-UHFFFAOYSA-N	-1	2	321.764	2.368	1	0		DEAFLM
O=C([O-])c1oc2cc(O)cc(O)c2c(=O)c1-c1ccc(O)cc1	ZINC000039189525	183014961	/nfs/dbraw/zinc/01/49/61/183014961.db2.gz	MTSPIFFMYHIYCY-UHFFFAOYSA-N	-1	2	314.249	2.275	1	0		DEAFLM
Nc1nc(-c2ccc([P@@](=O)([O-])O)o2)c(-c2ccccc2)s1	ZINC000040979759	183154643	/nfs/dbraw/zinc/15/46/43/183154643.db2.gz	SHZBUNXLGFOVOY-UHFFFAOYSA-N	-1	2	322.282	2.455	1	0		DEAFLM
Nc1nc(-c2ccc([P@](=O)([O-])O)o2)c(-c2ccccc2)s1	ZINC000040979759	183154647	/nfs/dbraw/zinc/15/46/47/183154647.db2.gz	SHZBUNXLGFOVOY-UHFFFAOYSA-N	-1	2	322.282	2.455	1	0		DEAFLM
Nc1nc(-c2ccc([P@@](=O)([O-])O)o2)c(C2CCCC2)s1	ZINC000066113403	184390496	/nfs/dbraw/zinc/39/04/96/184390496.db2.gz	IKTJCNUIUOCSHK-UHFFFAOYSA-N	-1	2	314.303	2.446	1	0		DEAFLM
Nc1nc(-c2ccc([P@](=O)([O-])O)o2)c(C2CCCC2)s1	ZINC000066113403	184390497	/nfs/dbraw/zinc/39/04/97/184390497.db2.gz	IKTJCNUIUOCSHK-UHFFFAOYSA-N	-1	2	314.303	2.446	1	0		DEAFLM
Nc1nc(-c2ccc([P@@](=O)([O-])O)o2)c(C2CCC2)s1	ZINC000066113401	184390725	/nfs/dbraw/zinc/39/07/25/184390725.db2.gz	CFUKADGETNMIPE-UHFFFAOYSA-N	-1	2	300.276	2.056	1	0		DEAFLM
Nc1nc(-c2ccc([P@](=O)([O-])O)o2)c(C2CCC2)s1	ZINC000066113401	184390727	/nfs/dbraw/zinc/39/07/27/184390727.db2.gz	CFUKADGETNMIPE-UHFFFAOYSA-N	-1	2	300.276	2.056	1	0		DEAFLM
O=C(Cc1ccc(O[P@](=O)([O-])O)cc1)Nc1ccccc1	ZINC000096932000	185392567	/nfs/dbraw/zinc/39/25/67/185392567.db2.gz	AQKQSOQOEDWWON-UHFFFAOYSA-N	-1	2	307.242	2.339	1	0		DEAFLM
O=C(Cc1ccc(O[P@@](=O)([O-])O)cc1)Nc1ccccc1	ZINC000096932000	185392568	/nfs/dbraw/zinc/39/25/68/185392568.db2.gz	AQKQSOQOEDWWON-UHFFFAOYSA-N	-1	2	307.242	2.339	1	0		DEAFLM
Nc1nc(-c2ccc([P@@](=O)([O-])O)o2)c(-c2ccco2)s1	ZINC000066101828	184389588	/nfs/dbraw/zinc/38/95/88/184389588.db2.gz	QOGYJLKVYJQGDK-UHFFFAOYSA-N	-1	2	312.243	2.048	1	0		DEAFLM
Nc1nc(-c2ccc([P@](=O)([O-])O)o2)c(-c2ccco2)s1	ZINC000066101828	184389590	/nfs/dbraw/zinc/38/95/90/184389590.db2.gz	QOGYJLKVYJQGDK-UHFFFAOYSA-N	-1	2	312.243	2.048	1	0		DEAFLM
CNc1nc(-c2ccc([P@@](=O)([O-])O)o2)c(CC(C)C)s1	ZINC000066102533	184389632	/nfs/dbraw/zinc/38/96/32/184389632.db2.gz	CSBMGTCSBDVFHI-UHFFFAOYSA-N	-1	2	316.319	2.446	1	0		DEAFLM
CNc1nc(-c2ccc([P@](=O)([O-])O)o2)c(CC(C)C)s1	ZINC000066102533	184389634	/nfs/dbraw/zinc/38/96/34/184389634.db2.gz	CSBMGTCSBDVFHI-UHFFFAOYSA-N	-1	2	316.319	2.446	1	0		DEAFLM
CCCSc1sc(N)nc1-c1ccc([P@@](=O)([O-])O)o1	ZINC000040981039	183154622	/nfs/dbraw/zinc/15/46/22/183154622.db2.gz	PDIWITFANCJCPM-UHFFFAOYSA-N	-1	2	320.332	2.290	1	0		DEAFLM
CCCSc1sc(N)nc1-c1ccc([P@](=O)([O-])O)o1	ZINC000040981039	183154623	/nfs/dbraw/zinc/15/46/23/183154623.db2.gz	PDIWITFANCJCPM-UHFFFAOYSA-N	-1	2	320.332	2.290	1	0		DEAFLM
CCCc1sc(N)nc1-c1ccc([P@@](=O)([O-])O)s1	ZINC000066102097	184389950	/nfs/dbraw/zinc/38/99/50/184389950.db2.gz	RPKTZPHRMLUFTG-UHFFFAOYSA-N	-1	2	304.333	2.209	1	0		DEAFLM
CCCc1sc(N)nc1-c1ccc([P@](=O)([O-])O)s1	ZINC000066102097	184389952	/nfs/dbraw/zinc/38/99/52/184389952.db2.gz	RPKTZPHRMLUFTG-UHFFFAOYSA-N	-1	2	304.333	2.209	1	0		DEAFLM
CC(=O)c1ccc([O-])c(C(=O)c2c(C)c(O)ccc2O)c1O	ZINC000013375414	560215488	/nfs/dbraw/zinc/21/54/88/560215488.db2.gz	VWHLSTXEUJVCHE-UHFFFAOYSA-N	-1	2	302.282	2.251	1	0	biogenic,in-vitro	DEAFLM