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)N([C@H](C)C(CCC#N)CCC#N)[P@@](=O)([O-])O	ZINC000086864274	327159505	/nfs/dbraw/zinc/15/95/05/327159505.db2.gz	VAUZKODBWOPXJN-LLVKDONJSA-N	-1	2	287.300	2.402	2	30		CEEFLM
CC(C)N([C@H](C)C(CCC#N)CCC#N)[P@](=O)([O-])O	ZINC000086864274	327159506	/nfs/dbraw/zinc/15/95/06/327159506.db2.gz	VAUZKODBWOPXJN-LLVKDONJSA-N	-1	2	287.300	2.402	2	30		CEEFLM
CC(C)C(=O)C1=C([O-])C(C)(C)C(=O)C(C)(C)C1=O	ZINC000015216509	560229358	/nfs/dbraw/zinc/22/93/58/560229358.db2.gz	ZOAWAFFEEBTHOX-UHFFFAOYSA-N	-1	2	252.310	2.228	1	30	biogenic,in-vitro	CEEFLM
CC(C)C([O-])=C1C(=O)C(C)(C)C(=O)C(C)(C)C1=O	ZINC000015216509	560229361	/nfs/dbraw/zinc/22/93/61/560229361.db2.gz	ZOAWAFFEEBTHOX-UHFFFAOYSA-N	-1	2	252.310	2.228	1	30	biogenic,in-vitro	CEEFLM
CC(C)N([C@@H](C)C(CCC#N)CCC#N)[P@@](=O)([O-])O	ZINC000086864273	327159475	/nfs/dbraw/zinc/15/94/75/327159475.db2.gz	VAUZKODBWOPXJN-NSHDSACASA-N	-1	2	287.300	2.402	2	30		CEEFLM
CC(C)N([C@@H](C)C(CCC#N)CCC#N)[P@](=O)([O-])O	ZINC000086864273	327159477	/nfs/dbraw/zinc/15/94/77/327159477.db2.gz	VAUZKODBWOPXJN-NSHDSACASA-N	-1	2	287.300	2.402	2	30		CEEFLM
O=C1C=C([O-])C(=O)C(c2c[nH]c3cccc(F)c32)C1=O	ZINC000043815561	175112457	/nfs/dbraw/zinc/11/24/57/175112457.db2.gz	BRODIEFQBFPGSI-UHFFFAOYSA-N	-1	2	273.219	2.170	1	30		CEEFLM