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Chemical structure of ZCZ 011

GB40425

ZCZ 011

Also known as 6-methyl-3-(2-nitro-1-thiophen-2-ylethyl)-2-phenyl-1H-indole

Brain penetrant cannabinoid CB1 receptor positive allosteric modulator (PAM) which augments the in vitro and in vivo pharmacological actions of the CB1 orthosteric agonists CP55940 (pEC50 value 6·90) and N-arachidonoylethanolamine (AEA) and reduces neuropathic pain in the mouse with no psychoactive effects

ChemicalCAS1998197-39-9MW362.44FormulaC21H18N2O2S
CAS number
1998197-39-9
Molecular weight
362.44
Formula
C21H18N2O2S
InChIKey
RJSPNRDBWHHFMH-UHFFFAOYSA-N
Catalogue number
GB40425
Brand
GLPBIO
Computed properties PubChem CID 71819307 · XLogP 5.3 · TPSA 89.9 Ų · H-bond donors 1
XLogP
5.3
TPSA
89.9 Ų
H-bond donors
1
H-bond acceptors
3
Rotatable bonds
4
Heavy atoms
26

SMILES CC1=CC2=C(C=C1)C(=C(N2)C3=CC=CC=C3)C(C[N+](=O)[O-])C4=CC=CS4

Computed descriptors from PubChem (CID 71819307), public domain. Identity cross-checked against the supplier's molecular formula and weight — verify before use.

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