smiles	zinc_id	prot_id	files.db2	substance.inchikey	net_charge	ph_mod_fk	substance.mwt	substance.logp	purchasable	reactive	features	tranche_name
C[C@H]1NCC(COP(=O)([O-])[O-])=C(CN[C@@H](/C=C/OCC[NH3+])C(=O)[O-])C1=O	ZINC000002047170	560186296	/nfs/dbraw/zinc/18/62/96/560186296.db2.gz	YUVPJAIAVDYTLF-SPQVTABLSA-N	-2	3	393.333	-1.515	1	30	in-vitro	GAEFHL
C[C@H]1NCC(COP(=O)([O-])[O-])=C(CN[C@H](/C=C/OCC[NH3+])C(=O)[O-])C1=O	ZINC000002047172	560186343	/nfs/dbraw/zinc/18/63/43/560186343.db2.gz	YUVPJAIAVDYTLF-GXPIAMGISA-N	-2	3	393.333	-1.515	1	30	in-vitro	GAEFHL
N#[N+][N-]c1c(F)c(=O)[n-]c(=O)n1[C@@H]1O[C@H](COP(=O)([O-])[O-])[C@@H](O)[C@H]1O	ZINC000040900065	205073570	/nfs/dbraw/zinc/07/35/70/205073570.db2.gz	ARRBQQMKVQEOHQ-UMMCILCDSA-N	-3	3	383.185	-1.242	1	30	in-vivo	GAEFHL