IBD Research Resource Center

BioID	bio197593
Name	DERACOXIB
ChEMBL ID	CHEMBL28636
Molecular Formula	C17H14F3N3O3S
Molecular Weight	397.38
Molecular Weight (Monoisotopic)	397.0708
Type	Small molecule
Max Phase	Phase 2
Target ID	Tar81
Target Name	None
Synonyms	DERACOXIB\|Deracoxib\|NSC-758935\|SC-59046
Smiles	COc1ccc(-c2cc(C(F)F)nn2-c2ccc(S(N)(=O)=O)cc2)cc1F
Inchi	InChI=1S/C17H14F3N3O3S/c1-26-16-7-2-10(8-13(16)18)15-9-14(17(19)20)22-23(15)11-3-5-12(6-4-11)27(21,24)25/h2-9,17H,1H3,(H2,21,24,25)
Inchi Key	WAZQAZKAZLXFMK-UHFFFAOYSA-N
Molecular Species	NEUTRAL
Targets	15.0
Bioactivities	33.0
Np Likeness Score	-1.75
Records Key	['2h', 'SID26749318', 'DERACOXIB', 'DERACOXIB', '229', 'SID170465679', 'SID144205056', '1393', 'DERACOXIB', 'Deracoxib', 'Deracoxib (3)', 'deracoxib', 'DERACOXIB', 'DERACOXIB', 'DERACOXIB', 'DERACOXIB', 'DERACOXIB']
Records Name	['4-[3-Difluoromethyl-5-(3-fluoro-4-methoxy-phenyl)-pyrazol-1-yl]-benzenesulfonamide', 'SID26749318', 'DERACOXIB', 'DERACOXIB', '4-[3-Difluoromethyl-5-(3-fluoro-4-methoxy-phenyl)-pyrazol-1-yl]-benzenesulfonamide', 'SID170465679', 'SID144205056', None, 'DERACOXIB', 'Deracoxib', '4-[3-Difluoromethyl-5-(3-fluoro-4-methoxy-phenyl)-pyrazol-1-yl]-benzenesulfonamide', 'deracoxib', 'DERACOXIB', 'DERACOXIB', 'DERACOXIB', 'DERACOXIB', 'DERACOXIB']
Withdrawn Flag	False
Orphan	0