smiles	zinc_id	prot_id	files.db2	substance.inchikey	net_charge	ph_mod_fk	substance.mwt	substance.logp	purchasable	reactive	features	tranche_name
CCC(CC)(C[P@@](=O)([O-])O)C(CC)(CC)P(=O)([O-])O	ZINC000095938340	426375379	/nfs/dbraw/zinc/37/53/79/426375379.db2.gz	SIAKEPZNZAQOAQ-UHFFFAOYSA-N	-2	2	316.271	2.707	2	0		DFAFLL
CCC(CC)(C[P@](=O)([O-])O)C(CC)(CC)P(=O)([O-])O	ZINC000095938340	426375383	/nfs/dbraw/zinc/37/53/83/426375383.db2.gz	SIAKEPZNZAQOAQ-UHFFFAOYSA-N	-2	2	316.271	2.707	2	0		DFAFLL
CCC(CC)(CP(=O)([O-])O)C(CC)(CC)[P@@](=O)([O-])O	ZINC000095938340	426375385	/nfs/dbraw/zinc/37/53/85/426375385.db2.gz	SIAKEPZNZAQOAQ-UHFFFAOYSA-N	-2	2	316.271	2.707	2	0		DFAFLL
CCC(CC)(CP(=O)([O-])O)C(CC)(CC)[P@](=O)([O-])O	ZINC000095938340	426375388	/nfs/dbraw/zinc/37/53/88/426375388.db2.gz	SIAKEPZNZAQOAQ-UHFFFAOYSA-N	-2	2	316.271	2.707	2	0		DFAFLL
CC(C)=CCC/C(C)=C/CC(P(=O)([O-])O)[P@@](=O)([O-])O	ZINC000013742033	560220333	/nfs/dbraw/zinc/22/03/33/560220333.db2.gz	HMRLDZHPNDPQNS-JXMROGBWSA-N	-2	2	312.239	2.751	1	0	in-vitro	DFAFLL
CC(C)=CCC/C(C)=C/CC(P(=O)([O-])O)[P@](=O)([O-])O	ZINC000013742033	560220334	/nfs/dbraw/zinc/22/03/34/560220334.db2.gz	HMRLDZHPNDPQNS-JXMROGBWSA-N	-2	2	312.239	2.751	1	0	in-vitro	DFAFLL