smiles	zinc_id	prot_id	files.db2	substance.inchikey	net_charge	ph_mod_fk	substance.mwt	substance.logp	purchasable	reactive	features	tranche_name
Cc1ccc(C(=O)C(=O)[O-])c([O-])c1O	258126394	573773021	/nfs/dbraw/zinc/77/30/21/573773021.db2.gz	QYZOSCPNLKETPV-UHFFFAOYSA-N	-2	1	196.158	0.674	10	10		ACCEML
CC(=O)c1cc(O)c([O-])cc1C(=O)[O-]	238136928	573821010	/nfs/dbraw/zinc/82/10/10/573821010.db2.gz	KMYVIKMSOWPWHO-UHFFFAOYSA-N	-2	1	196.158	0.999	10	10		ACCEML
O=Cc1ccc([O-])c(O)c1C(=O)[O-]	11919663	571956215	/nfs/dbraw/zinc/95/62/15/571956215.db2.gz	ZHZXXNUWCUEKIU-UHFFFAOYSA-N	-2	1	182.131	0.609	10	10		ACCEML
O=C([O-])C(=O)c1cccc(O)c1[O-]	75575828	171113736	/nfs/dbraw/zinc/11/37/36/171113736.db2.gz	LXAQDPXOLYVMNR-UHFFFAOYSA-N	-2	1	182.131	0.365	10	10		ACCEML
O=C(NO)C(=O)c1ccc([O-])c(O)c1	584650979	346742452	/nfs/dbraw/zinc/74/24/52/346742452.db2.gz	ZQGMMTVVRVABHH-SSDOTTSWSA-N	-2	1	197.146	0.424	10	10		ACCEML
O=C(NO)C(=O)c1ccc([O-])c(O)c1	584650980	346742499	/nfs/dbraw/zinc/74/24/99/346742499.db2.gz	ZQGMMTVVRVABHH-ZETCQYMHSA-N	-2	1	197.146	0.424	10	10		ACCEML