SB 216763   Click here for help

GtoPdb Ligand ID: 8015

Synonyms: SB-216763 | SB216763
Compound class: Synthetic organic
Comment: SB 216763 is a potent and selective inhibitor of glycogen synthase kinase 3 (GSK-3), equipotent at GSK-3α and GSK-3β isozymes [2]. The compound is an investigational tool which may be used to help clarify the role played by GSK-3 in cellular signalling.
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2D Structure
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Physico-chemical Properties
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Hydrogen bond acceptors 3
Hydrogen bond donors 1
Rotatable bonds 2
Topological polar surface area 51.1
Molecular weight 370.03
XLogP 4.66
No. Lipinski's rules broken 0
SMILES / InChI / InChIKey
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Canonical SMILES Clc1ccc(c(c1)Cl)C1=C(C(=O)NC1=O)c1cn(c2c1cccc2)C
Isomeric SMILES Clc1ccc(c(c1)Cl)C1=C(C(=O)NC1=O)c1cn(c2c1cccc2)C
InChI InChI=1S/C19H12Cl2N2O2/c1-23-9-13(11-4-2-3-5-15(11)23)17-16(18(24)22-19(17)25)12-7-6-10(20)8-14(12)21/h2-9H,1H3,(H,22,24,25)
InChI Key JCSGFHVFHSKIJH-UHFFFAOYSA-N
Classification Click here for help
Compound class Synthetic organic
IUPAC Name Click here for help
3-(2,4-dichlorophenyl)-4-(1-methylindol-3-yl)pyrrole-2,5-dione
Synonyms Click here for help
SB-216763 | SB216763
Database Links Click here for help
Specialist databases
Reactome Drug Reactome logo R-ALL-9687662
Reactome Reaction Reactome logo R-HSA-9687724
Other databases
CAS Registry No. 280744-09-4
ChEMBL Ligand CHEMBL102714
GtoPdb PubChem SID 249565695
PubChem CID 176158
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Tocris
SB 216763
Cat. No. 1616