smiles	zinc_id	prot_id	files.db2	substance.inchikey	net_charge	ph_mod_fk	substance.mwt	substance.logp	purchasable	reactive	features	tranche_name
CN(O)C(=O)CC[C@H](c1ccc(F)c(F)c1)P(=O)([O-])[O-]	ZINC000072116318	191038210	/nfs/dbraw/zinc/03/82/10/191038210.db2.gz	IZWIBRNXHRUNKD-SNVBAGLBSA-N	-2	3	309.205	1.811	1	30		DDEFHL
CC(=O)N(O)CC[C@@H](c1ccccc1CO)P(=O)([O-])[O-]	ZINC000072109636	191037594	/nfs/dbraw/zinc/03/75/94/191037594.db2.gz	RXQVFCZPTPRWIW-LBPRGKRZSA-N	-2	3	303.251	1.026	1	30		DDEFHL
CCCCCCCCC(O)(P(=O)([O-])[O-])P(=O)([O-])[O-]	ZINC000024951633	182396119	/nfs/dbraw/zinc/39/61/19/182396119.db2.gz	COHUUYPEYRMWTH-UHFFFAOYSA-N	-4	3	304.216	1.739	1	30	in-vivo	DDEFHL
COCc1ccccc1[C@H](CCN(O)C(C)=O)P(=O)([O-])[O-]	ZINC000072108726	191038193	/nfs/dbraw/zinc/03/81/93/191038193.db2.gz	NMDNXJBYPYZXRY-ZDUSSCGKSA-N	-2	3	317.278	1.680	1	30		DDEFHL
O=C([O-])CCn1cc(/C=N\[O-])c(-c2cccc([N+](=O)[O-])c2)n1	ZINC000006828928	181396090	/nfs/dbraw/zinc/39/60/90/181396090.db2.gz	FAERZIDQCYBZFX-AUWJEWJLSA-N	-2	3	304.262	1.741	1	30		DDEFHL
CN([O-])C(=O)CO[C@@H](c1ccc(F)cc1F)P(=O)([O-])[O-]	ZINC000095552851	185379385	/nfs/dbraw/zinc/37/93/85/185379385.db2.gz	LDCYXLKHLKMMGK-SNVBAGLBSA-N	-3	3	311.177	1.005	1	30		DDEFHL
CC(=O)N(O)CC[C@@H](c1ccccc1CCO)P(=O)([O-])[O-]	ZINC000072107363	191038305	/nfs/dbraw/zinc/03/83/05/191038305.db2.gz	BMRNXJROUCANLA-ZDUSSCGKSA-N	-2	3	317.278	1.068	1	30		DDEFHL
CC(=O)N(O)CC[C@H](c1ccccc1CO)P(=O)([O-])[O-]	ZINC000072109637	191038092	/nfs/dbraw/zinc/03/80/92/191038092.db2.gz	RXQVFCZPTPRWIW-GFCCVEGCSA-N	-2	3	303.251	1.026	1	30		DDEFHL
CCCCCCCCCCNC(=O)[C@H](N)COP(=O)([O-])[O-]	ZINC000043463163	183364873	/nfs/dbraw/zinc/36/48/73/183364873.db2.gz	YVEYAKHKJQUSFY-GFCCVEGCSA-N	-2	3	324.358	1.680	1	30		DDEFHL
CN([O-])C(=O)CO[C@H](c1ccc(F)c(F)c1)P(=O)([O-])[O-]	ZINC000095555784	185379651	/nfs/dbraw/zinc/37/96/51/185379651.db2.gz	XKRWMTQGABKZDX-JTQLQIEISA-N	-3	3	311.177	1.005	1	30		DDEFHL
COCc1ccccc1[C@@H](CCN(O)C(C)=O)P(=O)([O-])[O-]	ZINC000072108727	191037301	/nfs/dbraw/zinc/03/73/01/191037301.db2.gz	NMDNXJBYPYZXRY-CYBMUJFWSA-N	-2	3	317.278	1.680	1	30		DDEFHL
NC(=N[O-])c1ccc(S(=O)(=O)C=C([O-])c2ccccc2)cc1	ZINC000064415729	184296626	/nfs/dbraw/zinc/29/66/26/184296626.db2.gz	YBFVDZXVNZSAJP-UHFFFAOYSA-N	-2	3	318.354	1.438	1	30		DDEFHL
CN([O-])C(=O)CO[C@H](c1ccc(F)cc1F)P(=O)([O-])[O-]	ZINC000095552852	185379208	/nfs/dbraw/zinc/37/92/08/185379208.db2.gz	LDCYXLKHLKMMGK-JTQLQIEISA-N	-3	3	311.177	1.005	1	30		DDEFHL
CN(O)C(=O)CC[C@@H](c1ccc(F)c(F)c1)P(=O)([O-])[O-]	ZINC000072116317	191037639	/nfs/dbraw/zinc/03/76/39/191037639.db2.gz	IZWIBRNXHRUNKD-JTQLQIEISA-N	-2	3	309.205	1.811	1	30	in-vitro	DDEFHL
CC(=O)N(O)CC[C@H](c1ccccc1CCO)P(=O)([O-])[O-]	ZINC000072107364	191037799	/nfs/dbraw/zinc/03/77/99/191037799.db2.gz	BMRNXJROUCANLA-CYBMUJFWSA-N	-2	3	317.278	1.068	1	30		DDEFHL
CN([O-])C(=O)CO[C@@H](c1ccc(F)c(F)c1)P(=O)([O-])[O-]	ZINC000095555783	185379584	/nfs/dbraw/zinc/37/95/84/185379584.db2.gz	XKRWMTQGABKZDX-SNVBAGLBSA-N	-3	3	311.177	1.005	1	30		DDEFHL
CCCCCCCCCNC(P(=O)([O-])[O-])P(=O)([O-])[O-]	ZINC000034803909	581096929	/nfs/dbraw/zinc/09/69/29/581096929.db2.gz	LACBURUYQJYAPW-UHFFFAOYSA-N	-4	3	317.259	1.966	1	30		DDEFHL