smiles	zinc_id	prot_id	files.db2	substance.inchikey	net_charge	ph_mod_fk	substance.mwt	substance.logp	purchasable	reactive	features	tranche_name
C=CCCC/[NH+]=C/C=S	85531454	560073195	/nfs/dbraw/zinc/07/31/95/560073195.db2.gz	LSOCANBMZWWPQI-SOFGYWHQSA-N	1	1	141.239	2.023	1	30	biogenic,in-vitro	AEEFMO
S=C/C=[NH+]/CCc1ccccc1	85531493	560073207	/nfs/dbraw/zinc/07/32/07/560073207.db2.gz	OXKMPPAKLSXLDI-DHZHZOJOSA-N	1	1	177.272	2.300	1	30	biogenic,in-vitro	AEEFMO
C#CC[N@@H+]1CC=C(c2ccccc2)CC1	13729347	166020100	/nfs/dbraw/zinc/02/01/00/166020100.db2.gz	SNBCJSMRUFYWRI-UHFFFAOYSA-N	1	1	197.281	2.409	1	30		AEEFMO