smiles	zinc_id	prot_id	files.db2	substance.inchikey	net_charge	ph_mod_fk	substance.mwt	substance.logp	purchasable	reactive	features	tranche_name
COc1cc(N)c(Cl)cc1C(=O)N[C@@H]1CC[N@H+](CCCCCC(=O)O[C@H]2C[NH+]3CCC2CC3)C[C@@H]1OC	ZINC000013984697	561736176	/nfs/dbraw/zinc/73/61/76/561736176.db2.gz	VGDDOIZXGFJDRC-VJTSUQJLSA-N	2	1	537.101	2.948	10	0	investigational	KFAEMP
C[NH+]1CC[C@@]23c4c5c(O)ccc4C[C@@H]1[C@@H]2CC[C@](O)([C@H]1C[C@@H]2[C@@H]4Cc6ccc(O)c7c6[C@]2(CC[N@H+]4C)[C@H](O7)C1=O)[C@@H]3O5	ZINC000072399924	553651481	/nfs/dbraw/zinc/65/14/81/553651481.db2.gz	WWFJVDWQNGHXOR-IGJCWJHQSA-N	2	1	570.686	2.662	10	0	in-vitro	KFAEMP
C[NH+]1CC[C@@]23c4c5c(O)ccc4C[C@@H]1[C@@H]2CC[C@](O)([C@H]1C[C@@H]2[C@@H]4Cc6ccc(O)c7c6[C@]2(CC[N@@H+]4C)[C@H](O7)C1=O)[C@@H]3O5	ZINC000072399924	553651479	/nfs/dbraw/zinc/65/14/79/553651479.db2.gz	WWFJVDWQNGHXOR-IGJCWJHQSA-N	2	1	570.686	2.662	10	0	in-vitro	KFAEMP
C[NH+]1CC[C@]23c4c5c(O)ccc4C[C@H]1[C@H]2C[C@H]([C@@]1(O)CC[C@H]2[C@H]4Cc6ccc(O)c7c6[C@@]2(CC[N@@H+]4C)[C@H]1O7)C(=O)[C@H]3O5	ZINC000072399924	553651477	/nfs/dbraw/zinc/65/14/77/553651477.db2.gz	WWFJVDWQNGHXOR-IGJCWJHQSA-N	2	1	570.686	2.662	10	0	in-vitro	KFAEMP