smiles	zinc_id	prot_id	files.db2	substance.inchikey	net_charge	ph_mod_fk	substance.mwt	substance.logp	purchasable	reactive	features	tranche_name
COC(=O)c1cnc(N2CCC(F)(F)[C@]3(CC[N@H+](Cc4ccccn4)C3)C2)c(S(=O)(=O)F)c1	ZINC001164910611	721738071	/nfs/dbraw/zinc/73/80/71/721738071.db2.gz	GXXLUZPATFXGRD-FQEVSTJZSA-N	1	2	484.500	2.659	20	70		JFIDLO
COC(=O)c1cnc(N2CCC(F)(F)[C@]3(CC[N@@H+](Cc4ccccn4)C3)C2)c(S(=O)(=O)F)c1	ZINC001164910611	721738072	/nfs/dbraw/zinc/73/80/72/721738072.db2.gz	GXXLUZPATFXGRD-FQEVSTJZSA-N	1	2	484.500	2.659	20	70		JFIDLO
COC(=O)c1cnc(N2CCC(F)(F)[C@@]3(CC[N@H+](Cc4ccccn4)C3)C2)c(S(=O)(=O)F)c1	ZINC001164910620	721738342	/nfs/dbraw/zinc/73/83/42/721738342.db2.gz	GXXLUZPATFXGRD-HXUWFJFHSA-N	1	2	484.500	2.659	20	70		JFIDLO
COC(=O)c1cnc(N2CCC(F)(F)[C@@]3(CC[N@@H+](Cc4ccccn4)C3)C2)c(S(=O)(=O)F)c1	ZINC001164910620	721738346	/nfs/dbraw/zinc/73/83/46/721738346.db2.gz	GXXLUZPATFXGRD-HXUWFJFHSA-N	1	2	484.500	2.659	20	70		JFIDLO