smiles	zinc_id	prot_id	files.db2	substance.inchikey	net_charge	ph_mod_fk	substance.mwt	substance.logp	purchasable	reactive	features	tranche_name
CC(C)CC(C#N)=C([O-])N=[N+]=[N-]	238164292	572959461	/nfs/dbraw/zinc/95/94/61/572959461.db2.gz	DQFUSOZYCAVZCJ-LURJTMIESA-N	-1	3	166.184	2.009	10	70		AEIEHM
CC(C)CC(C#N)=C([O-])N=[N+]=[N-]	238172376	572964911	/nfs/dbraw/zinc/96/49/11/572964911.db2.gz	DQFUSOZYCAVZCJ-ZCFIWIBFSA-N	-1	3	166.184	2.009	10	70		AEIEHM
C/C=C\[C@H](C)OC(=S)[N-]CCC	218454924	573116539	/nfs/dbraw/zinc/11/65/39/573116539.db2.gz	FAUBJMJMTAEWIM-HORMHSFOSA-N	-1	3	187.308	2.252	10	70		AEIEHM
CCc1cc(F)cc(F)c1[O-]	217478771	344401676	/nfs/dbraw/zinc/40/16/76/344401676.db2.gz	BGLWPVQYHOKXAE-UHFFFAOYSA-N	-1	3	158.147	2.233	10	70		AEIEHM