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]1[NH2+]CC(CO[P@](=O)([O-])O)=C(C[NH2+][C@@H](/C=C/OCC[NH3+])C(=O)[O-])C1=O	ZINC000002047170	560186295	/nfs/dbraw/zinc/18/62/95/560186295.db2.gz	YUVPJAIAVDYTLF-SPQVTABLSA-N	1	2	393.333	-1.515	1	30	in-vitro	GAEFLO
C[C@H]1[NH2+]CC(CO[P@@](=O)([O-])O)=C(C[NH2+][C@@H](/C=C/OCC[NH3+])C(=O)[O-])C1=O	ZINC000002047170	560186293	/nfs/dbraw/zinc/18/62/93/560186293.db2.gz	YUVPJAIAVDYTLF-SPQVTABLSA-N	1	2	393.333	-1.515	1	30	in-vitro	GAEFLO
C[C@H]1[NH2+]CC(CO[P@](=O)([O-])O)=C(C[NH2+][C@H](/C=C/OCC[NH3+])C(=O)[O-])C1=O	ZINC000002047172	560186341	/nfs/dbraw/zinc/18/63/41/560186341.db2.gz	YUVPJAIAVDYTLF-GXPIAMGISA-N	1	2	393.333	-1.515	1	30	in-vitro	GAEFLO
C[C@H]1[NH2+]CC(CO[P@@](=O)([O-])O)=C(C[NH2+][C@H](/C=C/OCC[NH3+])C(=O)[O-])C1=O	ZINC000002047172	560186340	/nfs/dbraw/zinc/18/63/40/560186340.db2.gz	YUVPJAIAVDYTLF-GXPIAMGISA-N	1	2	393.333	-1.515	1	30	in-vitro	GAEFLO
[NH2+]=C1N[C@H]2[C@H](COC(=O)NS(=O)(=O)[O-])NC(=[NH2+])N3C[C@H](O)C(O)(O)[C@]23N1	ZINC000040430294	205065895	/nfs/dbraw/zinc/06/58/95/205065895.db2.gz	OWPNZRSEHXXIHR-LJRZAWCWSA-N	1	2	395.354	-5.033	1	30		GAEFLO
[NH2+]=C1N[C@@H]2[C@@H](COC(=O)NS(=O)(=O)[O-])NC(=[NH2+])N3CCC(O)(O)[C@@]23N1	ZINC000085847722	291092598	/nfs/dbraw/zinc/09/25/98/291092598.db2.gz	JKKCSFJSULZNDN-FJNYAOGASA-N	1	2	379.355	-3.795	1	30	endogenous,in-man	GAEFLO