SCHEMBL3454366-Boc
General
Type : Urea derivative,tert-Butyl,Piperidine
Chemical_Nomenclature : tert-butyl 4-(3-(4-isopropylphenyl)ureido)piperidine-1-carboxylate
Canonical SMILES : C1(=CC=C(C=C1)NC(=O)NC2CCN(CC2)C(C)(C)C)C(C)C
InChI : InChI=1S\/C19H31N3O\/c1-14(2)15-6-8-16(9-7-15)20-18(23)21-17-10-12-22(13-11-17)19(3,4)5\/h6-9,14,17H,10-13H2,1-5H3,(H2,20,21,23)
InChIKey : LNKMOFSVQMWROO-UHFFFAOYSA-N
Other name(s) :
MW : 317.47
Formula : C19H31N3O
CAS_number :
PubChem :
UniChem : LNKMOFSVQMWROO-UHFFFAOYSA-N
IUPHAR :
Wikipedia :
Target
Families : SCHEMBL3454366-Boc ligand of proteins in family: Epoxide_hydrolase
Stucture :
Protein : human-EPHX2
References (3)
| Title : How Robust Is the Ligand Binding Transition State? - Bose_2023_J.Am.Chem.Soc__ |
| Author(s) : Bose S , Lotz SD , Deb I , Shuck M , Lee KSS , Dickson A |
| Ref : Journal of the American Chemical Society , : , 2023 |
| Abstract : Bose_2023_J.Am.Chem.Soc__ |
| ESTHER : Bose_2023_J.Am.Chem.Soc__ |
| PubMedSearch : Bose_2023_J.Am.Chem.Soc__ |
| PubMedID: 37943667 |
| Gene_locus related to this paper: human-EPHX2 |
| Title : Preparation and evaluation of soluble epoxide hydrolase inhibitors with improved physical properties and potencies for treating diabetic neuropathic pain - Lee_2020_Bioorg.Med.Chem_28_115735 |
| Author(s) : Lee KSS , Ng JC , Yang J , Hwang SH , Morisseau C , Wagner K , Hammock BD |
| Ref : Bioorganic & Medicinal Chemistry , 28 :115735 , 2020 |
| Abstract : Lee_2020_Bioorg.Med.Chem_28_115735 |
| ESTHER : Lee_2020_Bioorg.Med.Chem_28_115735 |
| PubMedSearch : Lee_2020_Bioorg.Med.Chem_28_115735 |
| PubMedID: 33007552 |
| Title : Frster resonance energy transfer competitive displacement assay for human soluble epoxide hydrolase - Lee_2013_Anal.Biochem_434_259 |
| Author(s) : Lee KS , Morisseau C , Yang J , Wang P , Hwang SH , Hammock BD |
| Ref : Analytical Biochemistry , 434 :259 , 2013 |
| Abstract : Lee_2013_Anal.Biochem_434_259 |
| ESTHER : Lee_2013_Anal.Biochem_434_259 |
| PubMedSearch : Lee_2013_Anal.Biochem_434_259 |
| PubMedID: 23219719 |