smiles	zinc_id	prot_id	files.db2	substance.inchikey	net_charge	ph_mod_fk	substance.mwt	substance.logp	purchasable	reactive	features	tranche_name
COc1ccc([P@@](=O)([O-])O)cc1-c1nc(N)sc1C(C)C	ZINC000066102623	215011128	/nfs/dbraw/zinc/01/11/28/215011128.db2.gz	AFDPQACGMIKGBT-UHFFFAOYSA-N	-1	2	328.330	2.327	1	0		EEAFLM
COc1ccc([P@](=O)([O-])O)cc1-c1nc(N)sc1C(C)C	ZINC000066102623	215011131	/nfs/dbraw/zinc/01/11/31/215011131.db2.gz	AFDPQACGMIKGBT-UHFFFAOYSA-N	-1	2	328.330	2.327	1	0		EEAFLM
CC(=O)Nc1nc(-c2ccc([P@@](=O)([O-])O)o2)c(CC(C)C)s1	ZINC000066112017	215014104	/nfs/dbraw/zinc/01/41/04/215014104.db2.gz	VCHJDMLZLXDYLB-UHFFFAOYSA-N	-1	2	344.329	2.363	1	0		EEAFLM
CC(=O)Nc1nc(-c2ccc([P@](=O)([O-])O)o2)c(CC(C)C)s1	ZINC000066112017	215014106	/nfs/dbraw/zinc/01/41/06/215014106.db2.gz	VCHJDMLZLXDYLB-UHFFFAOYSA-N	-1	2	344.329	2.363	1	0		EEAFLM
CCCn1cc(C(=O)O)c(=O)c2ccc(N3C[C@@H](C)[NH2+][C@H](C)C3)cc21	ZINC000103286543	219282944	/nfs/dbraw/zinc/28/29/44/219282944.db2.gz	QBESLSOIJXVULU-CHWSQXEVSA-N	-1	2	343.427	2.296	1	0		EEAFLM
O=[P@@]([O-])(O)C[C@H](Cc1ccc(-c2ccccc2)cc1)c1nn[nH]n1	ZINC000026002131	202138227	/nfs/dbraw/zinc/13/82/27/202138227.db2.gz	ZMEJOIYGSSKOQA-HNNXBMFYSA-N	-1	2	344.311	2.371	1	0		EEAFLM
O=[P@]([O-])(O)C[C@H](Cc1ccc(-c2ccccc2)cc1)c1nn[nH]n1	ZINC000026002131	202138229	/nfs/dbraw/zinc/13/82/29/202138229.db2.gz	ZMEJOIYGSSKOQA-HNNXBMFYSA-N	-1	2	344.311	2.371	1	0		EEAFLM
Cc1oc(-c2nc(N)sc2-c2ccccc2)nc1[P@@](=O)([O-])O	ZINC000066103946	215011108	/nfs/dbraw/zinc/01/11/08/215011108.db2.gz	ZQHXELVSAIOSNM-UHFFFAOYSA-N	-1	2	337.297	2.159	1	0		EEAFLM
Cc1oc(-c2nc(N)sc2-c2ccccc2)nc1[P@](=O)([O-])O	ZINC000066103946	215011112	/nfs/dbraw/zinc/01/11/12/215011112.db2.gz	ZQHXELVSAIOSNM-UHFFFAOYSA-N	-1	2	337.297	2.159	1	0		EEAFLM
CCCn1cc(C(=O)O)c(=O)c2ccc(N3C[C@H](C)[NH2+][C@@H](C)C3)cc21	ZINC000103286545	219283462	/nfs/dbraw/zinc/28/34/62/219283462.db2.gz	QBESLSOIJXVULU-STQMWFEESA-N	-1	2	343.427	2.296	1	0		EEAFLM
O=[P@@]([O-])(O)C[C@@H](Cc1ccc(-c2ccccc2)cc1)c1nn[nH]n1	ZINC000026002124	202137722	/nfs/dbraw/zinc/13/77/22/202137722.db2.gz	ZMEJOIYGSSKOQA-OAHLLOKOSA-N	-1	2	344.311	2.371	1	0		EEAFLM
O=[P@]([O-])(O)C[C@@H](Cc1ccc(-c2ccccc2)cc1)c1nn[nH]n1	ZINC000026002124	202137724	/nfs/dbraw/zinc/13/77/24/202137724.db2.gz	ZMEJOIYGSSKOQA-OAHLLOKOSA-N	-1	2	344.311	2.371	1	0		EEAFLM
CCCn1cc(C(=O)O)c(=O)c2ccc(N3C[C@@H](C)[NH2+][C@@H](C)C3)cc21	ZINC000103286541	219283640	/nfs/dbraw/zinc/28/36/40/219283640.db2.gz	QBESLSOIJXVULU-BETUJISGSA-N	-1	2	343.427	2.296	1	0		EEAFLM
Nc1nc(-c2ccc([P@@](=O)([O-])O)o2)c(Cc2ccccc2)s1	ZINC000066104653	215013056	/nfs/dbraw/zinc/01/30/56/215013056.db2.gz	FLULGQBVCYKMNP-UHFFFAOYSA-N	-1	2	336.309	2.379	1	0		EEAFLM
Nc1nc(-c2ccc([P@](=O)([O-])O)o2)c(Cc2ccccc2)s1	ZINC000066104653	215013060	/nfs/dbraw/zinc/01/30/60/215013060.db2.gz	FLULGQBVCYKMNP-UHFFFAOYSA-N	-1	2	336.309	2.379	1	0		EEAFLM
COC(=O)c1cc(O)cc([O-])c1C(=O)c1c(O)cc(C)cc1OC	ZINC000029567858	202189871	/nfs/dbraw/zinc/18/98/71/202189871.db2.gz	HFBUAGQLOXYKLO-UHFFFAOYSA-N	-1	2	332.308	2.138	1	0		EEAFLM
CC(=O)N1C[C@@H]2CC[C@](C)(C1)c1ccc(O[P@@](=O)([O-])O)cc12	ZINC000029204920	202182970	/nfs/dbraw/zinc/18/29/70/202182970.db2.gz	CIPTXXZNGNDHLX-XHDPSFHLSA-N	-1	2	325.301	2.155	1	0		EEAFLM
CC(=O)N1C[C@@H]2CC[C@](C)(C1)c1ccc(O[P@](=O)([O-])O)cc12	ZINC000029204920	202182973	/nfs/dbraw/zinc/18/29/73/202182973.db2.gz	CIPTXXZNGNDHLX-XHDPSFHLSA-N	-1	2	325.301	2.155	1	0		EEAFLM