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Chemical structure of JWH 031 2'-isomer

GC41027

JWH 031 2'-isomer

Also known as (1-hexylpyrrol-2-yl)-naphthalen-1-ylmethanone

JWH 031 is a synthetic cannabinoid (CB) with a relatively low binding affinity for the central CB1 receptor (Ki = 399 nM) that is efficacious in reducing spontaneous activity and increasing antinociception in mice

ChemicalCAS1797106-18-3MW305.4FormulaC21H23NO
CAS number
1797106-18-3
Molecular weight
305.4
Formula
C21H23NO
Solubility
DMF: 10 mg/ml,DMSO: 10 mg/ml,Ethanol: 20 mg/ml
InChIKey
BLHPKPCKNONGJP-UHFFFAOYSA-N
Catalogue number
GC41027
Brand
GLPBIO
Computed properties PubChem CID 124518644 · XLogP 5.9 · TPSA 22 Ų · H-bond donors 0
XLogP
5.9
TPSA
22 Ų
H-bond donors
0
H-bond acceptors
1
Rotatable bonds
7
Heavy atoms
23

SMILES CCCCCCN1C=CC=C1C(=O)C2=CC=CC3=CC=CC=C32

Computed descriptors from PubChem (CID 124518644), public domain. Identity cross-checked against the supplier's molecular formula and weight — verify before use.

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