AM10257   Click here for help

GtoPdb Ligand ID: 10177

Synonyms: AM-10257
Compound class: Synthetic organic
Comment: AM10257 is a high affinity antagonist/inverse agonist of the cannabinoid CB2 receptor [1]. Low efficacy CB1 agonism has also been detected.
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2D Structure
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Physico-chemical Properties
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Hydrogen bond acceptors 4
Hydrogen bond donors 2
Rotatable bonds 9
Topological polar surface area 67.15
Molecular weight 421.27
XLogP 5.3
No. Lipinski's rules broken 1
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Canonical SMILES OCCCCCn1nc(c(c1c1ccccc1)C)C(=O)NC12CC3CC(C2)CC(C1)C3
Isomeric SMILES OCCCCCn1nc(c(c1c1ccccc1)C)C(=O)NC12CC3CC(C2)CC(C1)C3
InChI InChI=1S/C26H35N3O2/c1-18-23(25(31)27-26-15-19-12-20(16-26)14-21(13-19)17-26)28-29(10-6-3-7-11-30)24(18)22-8-4-2-5-9-22/h2,4-5,8-9,19-21,30H,3,6-7,10-17H2,1H3,(H,27,31)
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Molecular structure representations generated using Open Babel