Products for Research Use Only

GSK180736A

CAT: 0013-GTR19172215-09Size: 500 mgDry Ice: NoHazardous: No
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CAT#:0013-GTR19172215-09Size:500 mg
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Description
GSK180736A is a potent and selective GRK2 inhibitor (IC50 = 0.77 μM) with over 100-fold selectivity for GRK2 over other GRK isoforms. It also effectively inhibits ROCK1 (IC50 = 100 nM) and shows weaker activity against PKA. This compound is a valuable research tool for investigating GPCR signaling and Rho-ROCK pathways in cardiovascular and fibrotic disease models.
CAS Number
817194-38-0
Product Name Alternative
ROK, ROCK, Rho-kinase, Rho-associated kinase, Rho-associated protein kinase, PKA, Inhibitor, inhibit, GSK180736, GSK-180736, GSK180736A, GSK-180736A, GSK 180736, GRK1, GRK2, GRK5
Field of Research
Cell Biology, Pharmacology & Drug Discovery, Signal Transduction, Stem Cell & Developmental Biology
Purity
98.16% (May vary between batches)
Solubility
10% DMSO+40% PEG300+5% Tween 80+45% Saline:2 mg/mL (5.47 mM) ; H2O:< 1 mg/mL (insoluble or slightly soluble) ; DMSO:60 mg/mL (164.22 mM) ; Ethanol:3 mg/mL (8.21 mM)
Smiles
CC1=C (C (NC (=O) N1) c1ccc (F) cc1) C (=O) Nc1ccc2[nH]ncc2c1
Molecular Formula
C19H16FN5O2
Molecular Weight
365.36
Storage Conditions
-20°C
Notes
For research use only.

Chemical Information

Gsk180736A

GRK2 Inhibitor

CAS Number817194-38-0
PubChem CID11233873
IUPAC Name4-(4-fluorophenyl)-N-(1H-indazol-5-yl)-6-methyl-2-oxo-3,4-dihydro-1H-pyrimidine-5-carboxamide
Molecular FormulaC19H16FN5O2
Molecular Weight365.4
XLogP1.7
Topological Polar Surface Area98.9
Hydrogen Bond Donor Count4
Hydrogen Bond Acceptor Count4
Rotatable Bond Count3
Heavy Atom Count27
Formal Charge0
Complexity632
SMILES
CC1=C(C(NC(=O)N1)C2=CC=C(C=C2)F)C(=O)NC3=CC4=C(C=C3)NN=C4
InChI
InChI=1S/C19H16FN5O2/c1-10-16(17(24-19(27)22-10)11-2-4-13(20)5-3-11)18(26)23-14-6-7-15-12(8-14)9-21-25-15/h2-9,17H,1H3,(H,21,25)(H,23,26)(H2,22,24,27)
InChIKey
HEAIGWIZTYAQTC-UHFFFAOYSA-N
Chemical Structure
2D Structure
2D structure of Gsk180736A
CAS: 817194-38-0
CID: 11233873
Formula: C19H16FN5O2
MW: 365.4
Interactive 3D Structure
Loading 3D structure...
Computed Properties
PropertyValue
Molecular Weight365.4
XLogP31.7
Hydrogen Bond Donor Count4
Hydrogen Bond Acceptor Count4
Rotatable Bond Count3
Exact Mass365.12880293
Monoisotopic Mass365.12880293
Topological Polar Surface Area98.9 Ų
Heavy Atom Count27
Formal Charge0
Complexity632
Isotope Atom Count0
Defined Atom Stereocenter Count0
Undefined Atom Stereocenter Count1
Defined Bond Stereocenter Count0
Undefined Bond Stereocenter Count0
Covalently-Bonded Unit Count1
Compound Is CanonicalizedYes