GW405833   Click here for help

GtoPdb Ligand ID: 11149

Synonyms: GW 405833 | GW-405833 | L-768,242 | L768242
Compound class: Synthetic organic
Comment: Selective, high affinity CB2 receptor partial agonist.
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2D Structure
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Physico-chemical Properties
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Hydrogen bond acceptors 3
Hydrogen bond donors 0
Rotatable bonds 6
Topological polar surface area 43.7
Molecular weight 446.12
XLogP 4.12
No. Lipinski's rules broken 0
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Canonical SMILES COc1ccc2c(c1)c(CCN1CCOCC1)c(n2C(=O)c1cccc(c1Cl)Cl)C
Isomeric SMILES COc1ccc2c(c1)c(CCN1CCOCC1)c(n2C(=O)c1cccc(c1Cl)Cl)C
InChI InChI=1S/C23H24Cl2N2O3/c1-15-17(8-9-26-10-12-30-13-11-26)19-14-16(29-2)6-7-21(19)27(15)23(28)18-4-3-5-20(24)22(18)25/h3-7,14H,8-13H2,1-2H3
Selectivity at GPCRs
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Target Sp. Type Action Value Parameter Concentration range (M) Reference
CB2 receptor Hs Agonist Partial agonist 7.0 pEC50 - 1
pEC50 7.0 [1]
Description: cAMP assay using hCB2 ‐CHO cells.