smiles	zinc_id	prot_id	files.db2	substance.inchikey	net_charge	ph_mod_fk	substance.mwt	substance.logp	purchasable	reactive	features	tranche_name
O=C([O-])CC[C@]1(O)Oc2cc(O)c3c(c2=C1c1ccccc1)=CC([O-])=CC3=O	ZINC000013368986	210058883	/nfs/dbraw/zinc/05/88/83/210058883.db2.gz	AEXCWNZUQGRKDR-NRFANRHFSA-N	-2	0	380.352	2.672	1	30		GFEFRL
O=C([O-])c1cc(C#Cc2ccc(S(=O)(=O)[N-]c3ccccn3)cc2)ccc1O	ZINC000072125710	212058888	/nfs/dbraw/zinc/05/88/88/212058888.db2.gz	JJNQWYPLIWCKRB-UHFFFAOYSA-N	-2	0	394.408	2.686	1	30		GFEFRL
CCn1cc(C(=O)[O-])c(=O)c2cc(C#CCOCCCCCC(=O)[O-])ccc21	ZINC000058590740	206210039	/nfs/dbraw/zinc/21/00/39/206210039.db2.gz	GOTMWTMJAVTAQE-UHFFFAOYSA-N	-2	0	385.416	2.733	1	30		GFEFRL
O=C([O-])c1cccc(C#Cc2ccc(S(=O)(=O)[N-]c3ccccn3)cc2)c1	ZINC000072125042	209111156	/nfs/dbraw/zinc/11/11/56/209111156.db2.gz	FKSJWWYXAUHHOQ-UHFFFAOYSA-N	-2	0	378.409	2.980	1	30		GFEFRL
N#Cc1ccc(C(=O)[O-])c(N(C(=O)C(=O)[O-])c2cccc3ccc(O)cc32)c1	ZINC000043021625	210804584	/nfs/dbraw/zinc/80/45/84/210804584.db2.gz	LXJXQJDPVBEYEZ-UHFFFAOYSA-N	-2	0	376.324	2.865	1	30		GFEFRL
O=C([O-])CC[C@@]1(O)Oc2cc(O)c3c(c2=C1c1ccccc1)=CC([O-])=CC3=O	ZINC000013368984	210058276	/nfs/dbraw/zinc/05/82/76/210058276.db2.gz	AEXCWNZUQGRKDR-OAQYLSRUSA-N	-2	0	380.352	2.672	1	30		GFEFRL