JZL195   

GtoPdb Ligand ID: 8606

Synonyms: JZL 195 | JZL-195
Compound class: Synthetic organic
Comment: JZL195 was first reported as a dual inhibitor of fatty acid amide hydrolase (FAAH) and monoacylglycerol lipase (MGLL, a.k.a. MAGL) in 2009 [5]. Animal experiments suggest that dual FAAH/MAGL inhibitiors may have improved analgesic effects against neuropathic pain, in comparison to selective FAAH and MAGL inhibitors, or cannabinoid receptor agonists [1-2,4,6].
JZL195 has since been reported to also inhibit acyloxyacyl hydrolase (AOAH) [3]
2D Structure
Click here for structure editor
Physico-chemical Properties
Hydrogen bond acceptors 3
Hydrogen bond donors 0
Rotatable bonds 8
Topological polar surface area 85.15
Molecular weight 433.16
XLogP 4.32
No. Lipinski's rules broken 0
SMILES / InChI / InChIKey
Canonical SMILES O=C(N1CCN(CC1)Cc1cccc(c1)Oc1ccccc1)Oc1ccc(cc1)[N+](=O)[O-]
Isomeric SMILES O=C(N1CCN(CC1)Cc1cccc(c1)Oc1ccccc1)Oc1ccc(cc1)[N+](=O)[O-]
InChI InChI=1S/C24H23N3O5/c28-24(32-22-11-9-20(10-12-22)27(29)30)26-15-13-25(14-16-26)18-19-5-4-8-23(17-19)31-21-6-2-1-3-7-21/h1-12,17H,13-16,18H2
InChI Key QNYRAEKLMNDRFY-UHFFFAOYSA-N
Classification
Compound class Synthetic organic
IUPAC Name
(4-nitrophenyl) 4-[(3-phenoxyphenyl)methyl]piperazine-1-carboxylate
Synonyms
JZL 195 | JZL-195
Database Links
CAS Registry No. 1210004-12-8 (source: PubChem)
ChEMBL Ligand CHEMBL606201
GtoPdb PubChem SID 252166807
PubChem CID 46232606
Search Google for chemical match using the InChIKey QNYRAEKLMNDRFY-UHFFFAOYSA-N
Search Google for chemicals with the same backbone QNYRAEKLMNDRFY
Search UniChem for chemical match using the InChIKey QNYRAEKLMNDRFY-UHFFFAOYSA-N
Search UniChem for chemicals with the same backbone QNYRAEKLMNDRFY

Product suppliers

View disclaimer

Tocris
JZL 195
Cat. No. 4715