smiles	zinc_id	prot_id	files.db2	substance.inchikey	net_charge	ph_mod_fk	substance.mwt	substance.logp	purchasable	reactive	features	tranche_name
[NH3+][C@@H](CCC(=O)[O-])C(=O)N[C@@H](Cc1c[nH]c[nH+]1)C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)N[C@@H](CO)C(=O)[O-]	ZINC000101149671	554656990	/nfs/dbraw/zinc/65/69/90/554656990.db2.gz	FMJXVANOHHICFP-LEAZDLGRSA-N	-2	2	557.564	-1.600	50	0		KAAALL
[NH3+][C@@H](CCC(=O)[O-])C(=O)N[C@@H](Cc1c[nH+]c[nH]1)C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)N[C@@H](CO)C(=O)[O-]	ZINC000101149671	554656988	/nfs/dbraw/zinc/65/69/88/554656988.db2.gz	FMJXVANOHHICFP-LEAZDLGRSA-N	-2	2	557.564	-1.600	50	0		KAAALL
Nc1ncnc2c1ncn2[C@@H]1O[C@H]([C@H](O)O[P@@](=O)([O-])O[P@@](=O)([O-])O[P@](=O)([O-])O)[C@@H](O)[C@H]1O	ZINC000106114243	571411359	/nfs/dbraw/zinc/41/13/59/571411359.db2.gz	MWAOCBKOYZCOAI-WPZGLXJQSA-N	-3	2	523.181	-2.311	50	0		KAAALL
Nc1ncnc2c1ncn2[C@@H]1O[C@H]([C@H](O)O[P@@](=O)([O-])O[P@@](=O)([O-])O[P@@](=O)([O-])O)[C@@H](O)[C@H]1O	ZINC000106114243	571411358	/nfs/dbraw/zinc/41/13/58/571411358.db2.gz	MWAOCBKOYZCOAI-WPZGLXJQSA-N	-3	2	523.181	-2.311	50	0		KAAALL
Cc1cn([C@H]2C[C@H](O)[C@@H](CO[P@@](=O)([O-])O[C@H]3C[C@H](n4cc(C)c(=O)[nH]c4=O)O[C@@H]3CO[P@](=O)([O-])O)O2)c(=O)[nH]c1=O	ZINC000150343912	571459230	/nfs/dbraw/zinc/45/92/30/571459230.db2.gz	MMXKIWIWQPKTIK-KPRKPIBOSA-N	-2	2	626.405	-1.749	50	0		KAAALL
Cc1cn([C@H]2C[C@H](O)[C@@H](CO[P@@](=O)([O-])O[C@H]3C[C@H](n4cc(C)c(=O)[nH]c4=O)O[C@@H]3CO[P@@](=O)([O-])O)O2)c(=O)[nH]c1=O	ZINC000150343912	571459228	/nfs/dbraw/zinc/45/92/28/571459228.db2.gz	MMXKIWIWQPKTIK-KPRKPIBOSA-N	-2	2	626.405	-1.749	50	0		KAAALL