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Chemical structure of Vemircopan

GC63858

Vemircopan

Also known as (1R,3S,5R)-2-[2-[3-acetyl-5-(2-methylpyrimidin-5-yl)indazol-1-yl]acetyl]-N-(6-bromo-3-methyl-2-pyridinyl)-5-methyl-2-azabicyclo[3.1.0]hexane-3-carboxamide

Vemircopan (ALXN2050) is an orally active complement factor D inhibitor

ChemicalCAS2086178-00-7MW602.48FormulaC29H28BrN7O3
CAS number
2086178-00-7
Molecular weight
602.48
Formula
C29H28BrN7O3
Solubility
DMSO ： 50 mg/mL (82·99 mM; Need ultrasonic)
InChIKey
OCXAGXCMZACNEC-CTWZREHQSA-N
Catalogue number
GC63858
Brand
GLPBIO
Computed properties PubChem CID 126642840 · XLogP 4.1 · TPSA 123 Ų · H-bond donors 1
XLogP
4.1
TPSA
123 Ų
H-bond donors
1
H-bond acceptors
7
Rotatable bonds
6
Heavy atoms
40

SMILES CC1=C(N=C(C=C1)Br)NC(=O)[C@@H]2C[C@]3(C[C@H]3N2C(=O)CN4C5=C(C=C(C=C5)C6=CN=C(N=C6)C)C(=N4)C(=O)C)C

Computed descriptors from PubChem (CID 126642840), public domain. Identity cross-checked against the supplier's molecular formula and weight — verify before use.

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