smiles	zinc_id	prot_id	files.db2	substance.inchikey	net_charge	ph_mod_fk	substance.mwt	substance.logp	purchasable	reactive	features	tranche_name
N#Cc1c[nH]c2ncc(Cl)cc12	95910904	169115863	/nfs/dbraw/zinc/11/58/63/169115863.db2.gz	MOEPFOSHMIGVPW-UHFFFAOYSA-N	0	0	177.594	2.088	30	30		AEECRN
Cc1c(F)ccc(F)c1C#N	39088548	343197607	/nfs/dbraw/zinc/19/76/07/343197607.db2.gz	GIRMHLSPAMODBZ-UHFFFAOYSA-N	0	0	153.131	2.145	30	30		AEECRN
CCc1cc(C)cc(C#N)c1	67802569	343411169	/nfs/dbraw/zinc/41/11/69/343411169.db2.gz	WYEOLCFLUGHXAC-UHFFFAOYSA-N	0	0	145.205	2.429	30	30		AEECRN
Cc1ccc(-c2ncccn2)c(C#N)c1	140488541	344000592	/nfs/dbraw/zinc/00/05/92/344000592.db2.gz	ACBRZBTVCIFPCJ-UHFFFAOYSA-N	0	0	195.225	2.324	30	30		AEECRN
CCOc1ccc(F)c(F)c1C#N	307337058	345979331	/nfs/dbraw/zinc/97/93/31/345979331.db2.gz	ONRJFNBWFGFTQG-UHFFFAOYSA-N	0	0	183.157	2.235	30	30		AEECRN
SCc1cnc(Cl)s1	83348283	351645326	/nfs/dbraw/zinc/64/53/26/351645326.db2.gz	WKSWNTTUYFBJPT-UHFFFAOYSA-N	0	0	165.670	2.226	30	30		AEECRN