smiles	zinc_id	prot_id	files.db2	substance.inchikey	net_charge	ph_mod_fk	substance.mwt	substance.logp	purchasable	reactive	features	tranche_name
Cc1cc(O)c(C2=Nc3ccccc3S[C@@H](c3cc(Br)ccc3O)C2)c(=O)o1	ZINC000198979402	569873941	/nfs/dbraw/zinc/87/39/41/569873941.db2.gz	YDKIUKBWIGLLIQ-LJQANCHMSA-N	-2	2	458.333	5.480	50	0		JKAALL
Cc1[nH]n(-c2ccccc2)c(=O)c1C(c1c(C)[nH]n(-c2ccccc2)c1=O)c1cc(Cl)ccc1O	ZINC000100165106	569754538	/nfs/dbraw/zinc/75/45/38/569754538.db2.gz	QALCTWJKOQERMK-UHFFFAOYSA-N	-3	2	486.959	5.625	50	0		JKAALL
Cc1cc(O)c(C2=Nc3ccccc3S[C@@H](c3cc(Br)ccc3O)C2)c(=O)o1	ZINC000008740155	554642027	/nfs/dbraw/zinc/64/20/27/554642027.db2.gz	DIKZVSNKAWTORI-LJQANCHMSA-N	-2	2	458.333	5.480	50	0	biogenic	JKAALL