smiles	zinc_id	prot_id	files.db2	substance.inchikey	net_charge	ph_mod_fk	substance.mwt	substance.logp	purchasable	reactive	features	tranche_name
Cc1c(C(=O)NC2CCN(C(=O)Oc3ccc([N+](=O)[O-])cc3)CC2)nn(-c2ccc(Cl)cc2Cl)c1-c1ccc(Cl)cc1	ZINC000217333764	562877522	/nfs/dbraw/zinc/87/75/22/562877522.db2.gz	GQJLNTYAYWLNFG-UHFFFAOYSA-N	0	0	628.900	7.109	1	50		KKGFRN
CCCCCCCCCCCCCCCC(=O)OC[C@@H](CO[P@@](=O)([O-])OCC[N+](C)(C)C)OC(=O)CCC[C@H](O)/C=C/C=O	ZINC000008437604	717106955	/nfs/dbraw/zinc/10/69/55/717106955.db2.gz	LQATVQHXAXOSAU-PQMQNFANSA-O	0	0	650.811	6.049	1	50	in-vitro	KKGFRN
CCCCCCCC[C@@H](Br)[C@H](Br)CCCCCCCCO[P@@](=O)([O-])OCC[N+](C)(C)C	ZINC000043022036	717128306	/nfs/dbraw/zinc/12/83/06/717128306.db2.gz	RUUABZPZVNLUHZ-DHIUTWEWSA-O	0	0	594.430	7.835	1	50		KKGFRN
CCCCCCCC[C@H](Br)[C@@H](Br)CCCCCCCCO[P@@](=O)([O-])OCC[N+](C)(C)C	ZINC000043022038	717128351	/nfs/dbraw/zinc/12/83/51/717128351.db2.gz	RUUABZPZVNLUHZ-GOTSBHOMSA-O	0	0	594.430	7.835	1	50		KKGFRN
CCCCCCCC[C@H](Br)[C@H](Br)CCCCCCCCO[P@@](=O)([O-])OCC[N+](C)(C)C	ZINC000043022033	717128590	/nfs/dbraw/zinc/12/85/90/717128590.db2.gz	RUUABZPZVNLUHZ-XZOQPEGZSA-O	0	0	594.430	7.835	1	50		KKGFRN
CCCCCCCC[C@@H](Br)[C@@H](Br)CCCCCCCCO[P@@](=O)([O-])OCC[N+](C)(C)C	ZINC000043022041	717128297	/nfs/dbraw/zinc/12/82/97/717128297.db2.gz	RUUABZPZVNLUHZ-PKTZIBPZSA-O	0	0	594.430	7.835	1	50		KKGFRN