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Chemical structure of Rho-Kinase-IN-3

GC70451

Rho-Kinase-IN-3

Also known as N-(1H-indazol-5-yl)-6-methyl-4-naphthalen-2-yl-2-oxo-3,4-dihydro-1H-pyridine-5-carboxamide

Rho-Kinase-IN-3 (compound 12) is a potent and selective Rho kinase (ROCK1) inhibitor with an IC50 value of 8 nM

ChemicalCAS864082-23-5MW396.44FormulaC24H20N4O2
CAS number
864082-23-5
Molecular weight
396.44
Formula
C24H20N4O2
InChIKey
ODLNBFNBEPOFNC-UHFFFAOYSA-N
Catalogue number
GC70451
Brand
GLPBIO
Computed properties PubChem CID 11269477 · XLogP 3.2 · TPSA 86.9 Ų · H-bond donors 3
XLogP
3.2
TPSA
86.9 Ų
H-bond donors
3
H-bond acceptors
3
Rotatable bonds
3
Heavy atoms
30

SMILES CC1=C(C(CC(=O)N1)C2=CC3=CC=CC=C3C=C2)C(=O)NC4=CC5=C(C=C4)NN=C5

Computed descriptors from PubChem (CID 11269477), public domain. Identity cross-checked against the supplier's molecular formula and weight — verify before use.

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