CHEMBL4437989
specific for MGLL over FAAH IC50 MGLL 20nM
General
Type : Piperazine, Pyrazole, Cyanide
Chemical_Nomenclature : 1-[4-[bis(4-phenylmethoxyphenyl)methyl]piperazine-1-carbonyl]pyrazole-4-carbonitrile
Canonical SMILES : C1CN(CCN1C(C2=CC=C(C=C2)OCC3=CC=CC=C3)C4=CC=C(C=C4)OCC5=CC=CC=C5)C(=O)N6C=C(C=N6)C#N
InChI : InChI=1S\/C36H33N5O3\/c37-23-30-24-38-41(25-30)36(42)40-21-19-39(20-22-40)35(31-11-15-33(16-12-31)43-26-28-7-3-1-4-8-28)32-13-17-34(18-14-32)44-27-29-9-5-2-6-10-29\/h1-18,24-25,35H,19-22,26-27H2
InChIKey : GBNHZQHAOJZSIB-UHFFFAOYSA-N
Other name(s) : BDBM50505194 || Compound 46c
MW : 583.7
Formula : C36H33N5O3
CAS_number :
PubChem : 155513119
UniChem : GBNHZQHAOJZSIB-UHFFFAOYSA-N
Target
Families : CHEMBL4437989 ligand of proteins in family
Monoglyceridelipase_lysophospholip
Protein :
human-MGLL
References (1)
| Title : N-Acyl pyrazoles: Effective and tunable inhibitors of serine hydrolases - Otrubova_2019_Bioorg.Med.Chem_27_1693 |
| Author(s) : Otrubova K , Chatterjee S , Ghimire S , Cravatt BF , Boger DL |
| Ref : Bioorganic & Medicinal Chemistry , 27 :1693 , 2019 |
| Abstract : |
| PubMedSearch : Otrubova_2019_Bioorg.Med.Chem_27_1693 |
| PubMedID: 30879861 |