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(CC(=O)C(=O)[O-])C(=O)[O-]	13539559	560219032	/nfs/dbraw/zinc/21/90/32/560219032.db2.gz	IPWNMCXZUUQQTP-DUXPYHPUSA-N	-2	1	158.109	0.154	1	0	in-vitro	ACAFML
CC(C)(CC[P@](=O)([O-])O)C(=O)[O-]	29747211	166394843	/nfs/dbraw/zinc/39/48/43/166394843.db2.gz	SCXPEAQTFILILV-UHFFFAOYSA-N	-2	1	196.139	0.665	1	0		ACAFML
CO[P@](=O)([O-])C(=O)[O-]	26642694	168221354	/nfs/dbraw/zinc/22/13/54/168221354.db2.gz	NIWVUSLHJTWEBE-UHFFFAOYSA-N	-2	1	140.031	0.496	1	0		ACAFML
[O-]C([O-])=S	59092131	171101692	/nfs/dbraw/zinc/10/16/92/171101692.db2.gz	WRWHFVRDUAQRIQ-UHFFFAOYSA-N	-2	1	78.092	0.387	1	0	in-vitro	ACAFML