smiles	zinc_id	prot_id	files.db2	substance.inchikey	net_charge	ph_mod_fk	substance.mwt	substance.logp	purchasable	reactive	features	tranche_name
CO[C@@H]1C=CO[C@@]2(C)Oc3c(c4c5nc6cc(C)ccn6c5c(c([O-])c4c([O-])c3C)NC(=O)/C(C)=C\C=C/[C@H](C)[C@H](O)[C@H](C)[C@H](O)[C@H](C)[C@H](OC(C)=O)[C@@H]1C)C2=O	ZINC000242581600	572198726	/nfs/dbraw/zinc/19/87/26/572198726.db2.gz	NZCRJKRKKOLAOJ-IEVVQVBSSA-N	-2	3	785.891	6.158	10	5		KKBEHL
CO[C@@H]1C=CO[C@@]2(C)Oc3c(c4c5nc6cc(C)ccn6c5c(c([O-])c4c([O-])c3C)NC(=O)/C(C)=C\C=C/[C@H](C)[C@H](O)[C@H](C)[C@H](O)[C@H](C)[C@H](OC(C)=O)[C@H]1C)C2=O	ZINC000242581603	572198694	/nfs/dbraw/zinc/19/86/94/572198694.db2.gz	NZCRJKRKKOLAOJ-CTNOSIHFSA-N	-2	3	785.891	6.158	10	5		KKBEHL
COc1cc([O-])c2c(c1)c(-c1c(OC)cc3cc4oc(C)cc([O-])c-4c(=O)c3c1OC)c1oc(C)cc([O-])c-1c2=O	ZINC000000897910	560125915	/nfs/dbraw/zinc/12/59/15/560125915.db2.gz	DVSATZLPJVYIRI-UHFFFAOYSA-N	-3	3	556.523	5.632	10	5	endogenous,in-man	KKBEHL
CCCCCc1cc2ccc3c([O-])c4c(cc3c2c(O)c1C(=O)[O-])C(C)(C)c1cc([O-])cc(O)c1C4=O	ZINC000001554627	560182158	/nfs/dbraw/zinc/18/21/58/560182158.db2.gz	LKGKHTANQJZVPR-UHFFFAOYSA-N	-3	3	500.547	6.117	10	5	in-vitro	KKBEHL
CO[C@@H]1C=CO[C@@]2(C)Oc3c(c4c5nc6cc(C)ccn6c5c(c([O-])c4c([O-])c3C)NC(=O)/C(C)=C\C=C/[C@H](C)[C@H](O)[C@H](C)[C@H](O)[C@H](C)[C@@H](OC(C)=O)[C@H]1C)C2=O	ZINC000242581607	572198702	/nfs/dbraw/zinc/19/87/02/572198702.db2.gz	NZCRJKRKKOLAOJ-OGTFMJCPSA-N	-2	3	785.891	6.158	10	5		KKBEHL