CHEMBL4441719
IC50 human MGLL 0.127 microM; rat FAAH IC50 0.067 microM; inactive on ABHD6
General
Type : Cyanide, Piperazine, Carbamate
Chemical_Nomenclature : (3-cyanophenyl) 4-cyclohexylpiperazine-1-carboxylate
Canonical SMILES : C1CCC(CC1)N2CCN(CC2)C(=O)OC3=CC=CC(=C3)C#N
InChI : InChI=1S\/C18H23N3O2\/c19-14-15-5-4-8-17(13-15)23-18(22)21-11-9-20(10-12-21)16-6-2-1-3-7-16\/h4-5,8,13,16H,1-3,6-7,9-12H2
InChIKey : VCXOANNNXFITEU-UHFFFAOYSA-N
Other name(s) : BDBM50520886
MW : 313.4
Formula : C18H23N3O2
CAS_number :
PubChem : 155515580
UniChem : VCXOANNNXFITEU-UHFFFAOYSA-N
Target
Families : CHEMBL4441719 ligand of proteins in family
Monoglyceridelipase_lysophospholip
Protein :
human-MGLL
References (1)
| Title : Synthesis and evaluation of potent and selective MGL inhibitors as a glaucoma treatment - Alapafuja_2019_Bioorg.Med.Chem_27_55 |
| Author(s) : Alapafuja SO , Malamas MS , Shukla V , Zvonok A , Miller S , Daily L , Rajarshi G , Miyabe CY , Chandrashekhar H , Wood J , Tyukhtenko S , Straiker A , Makriyannis A |
| Ref : Bioorganic & Medicinal Chemistry , 27 :55 , 2019 |
| Abstract : |
| PubMedSearch : Alapafuja_2019_Bioorg.Med.Chem_27_55 |
| PubMedID: 30446439 |