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Compound Detail

CHEMBL4594382

DEURUXOLITINIB PHOSPHATE
💊 Approved Drug
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💊 Approved Drug
O=P(O)(O)O.[2H]C1([2H])C([C@@H](CC#N)n2cc(-c3ncnc4[nH]ccc34)cn2)C([2H])([2H])C([2H])([2H])C1([2H])[2H]

Basic Information

ChEMBL ID CHEMBL4594382
Name DEURUXOLITINIB PHOSPHATE
Phase Approved
Structure Type MOL
InChI Key JFMWPOCYMYGEDM-NTVOUFPTSA-N
Therapeutic ✓ Yes
Parent Compound CHEMBL1789941
Active Moiety CHEMBL1789941

Known Names

C-21543 phosphate CTP-543 phosphate D8- ruxolitinib phosphate D8-ruxolitinib phosphate Deuruxolitinib phosphate Leqselvi
0
Targets
0
Activities
0
Assay Types
0
PK Parameters
0
Publications
6
Known Names
1
Indications
4
Mechanisms

Molecular Properties

306.4
MW (Da)
3.47
ALogP
5
HBA
1
HBD
83.2
PSA (Ų)
0.80
QED
0
Ro5 Violations
4
Rot. Bonds

Drug Information

Molecule Type Small molecule
First Approval 2024
Availability Prescription
Chirality Single Enantiomer

Routes of Administration

Oral

Flags

Black Box Warning
USAN Stem deu-; -tinib
USAN Year 2020

Extended Properties

Molecular Formula C17H21N6O4P
MW 412.42
Aromatic Rings 3
Heavy Atoms 23
NP-Likeness -0.90

Mechanism of Action

Mechanism Action Type Target Direct Efficacy
Tyrosine-protein kinase JAK3 inhibitor INHIBITOR Tyrosine-protein kinase JAK3
Tyrosine-protein kinase JAK2 inhibitor INHIBITOR Tyrosine-protein kinase JAK2
Tyrosine-protein kinase JAK1 inhibitor INHIBITOR Tyrosine-protein kinase JAK1
Tyrosine-protein kinase TYK2 inhibitor INHIBITOR Non-receptor tyrosine-protein kinase TYK2

Indications

Alopecia Areata

Drug Warnings

Black Box Warning
General Warning
Country: United States

Data from ChEMBL 36 via Core Engine