smiles	zinc_id	prot_id	files.db2	substance.inchikey	net_charge	ph_mod_fk	substance.mwt	substance.logp	purchasable	reactive	features	tranche_name
O=[P@]([O-])(O)[C@@H](Cc1cccc(Oc2ccccc2)c1)S(=O)(=O)[O-]	ZINC000040872814	205082447	/nfs/dbraw/zinc/08/24/47/205082447.db2.gz	QZTDQEVQGQAOKB-CQSZACIVSA-N	-2	1	358.308	2.413	1	0	in-vitro	FEAFML
O=[P@]([O-])(O)CN[C@@H](Cc1ccc2c(c1)oc1ccccc12)c1nnn[n-]1	ZINC000003981919	204116814	/nfs/dbraw/zinc/11/68/14/204116814.db2.gz	HYXPDXHZGJELSV-ZDUSSCGKSA-N	-2	1	373.309	2.108	1	0		FEAFML
COc1cc(C[C@H](NC[P@](=O)([O-])O)C(=O)[O-])ccc1-c1ccccc1	ZINC000001538359	204012456	/nfs/dbraw/zinc/01/24/56/204012456.db2.gz	NQRRDOIDNXKLSF-HNNXBMFYSA-N	-2	1	365.322	2.083	1	0		FEAFML
N=C(N)Nc1cccc(C(=O)Nc2ccc(C=CC(=O)[O-])c(C(=O)[O-])c2)c1	ZINC000029250810	204896364	/nfs/dbraw/zinc/89/63/64/204896364.db2.gz	VOZZIKGZFLWFGA-FNORWQNLSA-N	-2	1	368.349	2.040	1	0		FEAFML
O=C(NCc1ccc(F)c(Cl)c1)c1c([O-])c2cccnc2n([O-])c1=O	ZINC000103253100	209251210	/nfs/dbraw/zinc/25/12/10/209251210.db2.gz	ZMWNOXHZOQBNOQ-UHFFFAOYSA-N	-2	1	363.732	2.062	1	0		FEAFML
O=[P@]([O-])(O)[C@H](Cc1cccc(Oc2ccccc2)c1)S(=O)(=O)[O-]	ZINC000040872812	205082659	/nfs/dbraw/zinc/08/26/59/205082659.db2.gz	QZTDQEVQGQAOKB-AWEZNQCLSA-N	-2	1	358.308	2.413	1	0	in-vitro	FEAFML
CC(=O)N[C@H](CSC(=S)[N-]CCCCc1ccccc1)C(=O)[O-]	ZINC000040392996	208250255	/nfs/dbraw/zinc/25/02/55/208250255.db2.gz	LITKDIAXAOEWHC-CQSZACIVSA-N	-2	1	354.497	2.206	1	0		FEAFML
CN1O[C@H](c2ccccc2)[C@@H](C(=O)c2ccccc2O)[C@H]1P(=O)([O-])[O-]	ZINC000071330757	221344197	/nfs/dbraw/zinc/34/41/97/221344197.db2.gz	PXPGHUJLRBRORZ-DJIMGWMZSA-N	-2	1	363.306	2.313	1	0		FEAFML
O=C([O-])C(=O)Nc1sc2c(c1C(=O)[O-])CCN(Cc1ccccc1)C2	ZINC000013491477	220070274	/nfs/dbraw/zinc/07/02/74/220070274.db2.gz	DNUOCYUTEIKZFI-UHFFFAOYSA-N	-2	1	360.391	2.028	1	0		FEAFML