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(=C\c1ccc(N(C)C)cc1)C(=O)N[C@H]1[C@@H]([NH+](C)C)[C@@H]2O[C@@H](O[C@H](C(=O)[O-])[C@H](O)CO)O[C@@H]2[C@H](O)[C@H]1O	ZINC000103230317	562818150	/nfs/dbraw/zinc/81/81/50/562818150.db2.gz	LPVLOXICDYAAJH-FTJFNIASSA-N	0	1	539.582	-1.803	1	10		KACFMN
C/C(=C\c1ccc(N(C)C)cc1)C(=O)N[C@H]1[C@@H]([NH+](C)C)[C@@H]2O[C@@H](O[C@@H](C(=O)[O-])[C@H](O)CO)O[C@@H]2[C@H](O)[C@H]1O	ZINC000103230324	562818212	/nfs/dbraw/zinc/81/82/12/562818212.db2.gz	LPVLOXICDYAAJH-LUWAHSPISA-N	0	1	539.582	-1.803	1	10		KACFMN
C/C(=C\c1ccc(N(C)C)cc1)C(=O)N[C@H]1[C@@H]([NH+](C)C)[C@@H]2O[C@@H](O[C@@H](C(=O)[O-])[C@@H](O)CO)O[C@@H]2[C@H](O)[C@H]1O	ZINC000169308263	562854040	/nfs/dbraw/zinc/85/40/40/562854040.db2.gz	LPVLOXICDYAAJH-QKPDPFPWSA-N	0	1	539.582	-1.803	1	10		KACFMN
C/C(=C\c1ccc(N(C)C)cc1)C(=O)N[C@H]1[C@@H]([NH+](C)C)[C@@H]2O[C@@H](O[C@H](C(=O)[O-])[C@@H](O)CO)O[C@@H]2[C@H](O)[C@H]1O	ZINC000169308269	562854045	/nfs/dbraw/zinc/85/40/45/562854045.db2.gz	LPVLOXICDYAAJH-LWTHLLSHSA-N	0	1	539.582	-1.803	1	10	in-vitro	KACFMN