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)(CCCC#CCn1cc[nH+]c1)C(=O)[O-]	ZINC000036242049	187248933	/nfs/dbraw/zinc/24/89/33/187248933.db2.gz	SJMNXTTWYMDEOO-UHFFFAOYSA-N	0	2	234.299	2.168	1	30		BEEFLN
C=CCCCC(=O)c1c(O)cc(C)oc1=O	ZINC000095583123	188146999	/nfs/dbraw/zinc/14/69/99/188146999.db2.gz	OKGZXDRJHOUDOI-UHFFFAOYSA-N	0	2	222.240	2.193	1	30		BEEFLN
COC(=O)c1ccc(O)c(C(=O)C=C(C)C)c1	ZINC000014489183	560221807	/nfs/dbraw/zinc/22/18/07/560221807.db2.gz	MYNYNZOFYYKQDQ-UHFFFAOYSA-N	0	2	234.251	2.328	1	30	biogenic,in-vitro	BEEFLN
CC1=CC(=O)C(=C(O)c2ccccc2)C1=O	ZINC000100487050	168090649	/nfs/dbraw/zinc/09/06/49/168090649.db2.gz	WJVJLHODFNMPPO-ACCUITESSA-N	0	2	214.220	2.054	1	30		BEEFLN