smiles	zinc_id	prot_id	files.db2	substance.inchikey	net_charge	ph_mod_fk	substance.mwt	substance.logp	purchasable	reactive	features	tranche_name
C=C(P(=O)([O-])O)[P@](=O)([O-])O	4342447	166140241	/nfs/dbraw/zinc/14/02/41/166140241.db2.gz	LUHPUPVJIVTJOE-UHFFFAOYSA-N	-2	2	188.012	-0.187	50	0		ABAALL
C=C(P(=O)([O-])O)[P@@](=O)([O-])O	4342447	166140255	/nfs/dbraw/zinc/14/02/55/166140255.db2.gz	LUHPUPVJIVTJOE-UHFFFAOYSA-N	-2	2	188.012	-0.187	50	0		ABAALL
O=C([O-])C1C(C(=O)[O-])C1C(=O)O	77609	169336295	/nfs/dbraw/zinc/33/62/95/169336295.db2.gz	UVIRSBTTXOHPDA-UHFFFAOYSA-N	-2	2	174.108	-0.898	50	0	in-vitro	ABAALL
O=C([O-])[P@](=O)([O-])O	8101109	169344696	/nfs/dbraw/zinc/34/46/96/169344696.db2.gz	ZJAOAACCNHFJAH-UHFFFAOYSA-N	-2	2	126.004	-0.158	50	0	fda	ABAALL
O=C([O-])[P@@](=O)([O-])O	8101109	169344697	/nfs/dbraw/zinc/34/46/97/169344697.db2.gz	ZJAOAACCNHFJAH-UHFFFAOYSA-N	-2	2	126.004	-0.158	50	0	fda	ABAALL
O=P([O-])(O)CC[P@](=O)([O-])O	3953973	351323672	/nfs/dbraw/zinc/32/36/72/351323672.db2.gz	XYJLPCAKKYOLGU-UHFFFAOYSA-N	-2	2	190.028	-0.658	50	0	in-vitro	ABAALL
O=P([O-])(O)CC[P@@](=O)([O-])O	3953973	351323677	/nfs/dbraw/zinc/32/36/77/351323677.db2.gz	XYJLPCAKKYOLGU-UHFFFAOYSA-N	-2	2	190.028	-0.658	50	0	in-vitro	ABAALL
O=P([O-])(O)C[P@](=O)([O-])O	8015016	351354954	/nfs/dbraw/zinc/35/49/54/351354954.db2.gz	MBKDYNNUVRNNRF-UHFFFAOYSA-N	-2	2	176.001	-0.701	50	0	fda	ABAALL
O=P([O-])(O)C[P@@](=O)([O-])O	8015016	351354960	/nfs/dbraw/zinc/35/49/60/351354960.db2.gz	MBKDYNNUVRNNRF-UHFFFAOYSA-N	-2	2	176.001	-0.701	50	0	fda	ABAALL