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Inhibitor Report for: 5ALG-R4N

General
Type Carboxamide, Sulfur Compound
Chemical_Nomenclature 4-[(3-chlorophenyl)methyl]-N-[[(3S)-2,3-dihydro-1,4-benzodioxin-3-yl]methyl]-3-oxo-1,4-benzothiazine-6-carboxamide
Canonical SMILES C1C(OC2=CC=CC=C2O1)CNC(=O)C3=CC4=C(C=C3)SCC(=O)N4CC5=CC(=CC=C5)Cl
InChI InChI=1S/C25H21ClN2O4S/c26-18-5-3-4-16(10-18)13-28-20-11-17(8-9-23(20)33-15-24(28)29)25(30)27-12-19-14-31-21-6-1-2-7-22(21)32-19/h1-11,19H,12-15H2,(H,27,30)/t19-/m0/s1
InChIKey JDJXOOKBURTXCO-IBGZPJMESA-N
Other name(s) Q27464850 ; R4N ; ZINC000230472211
________________________________________________________________________________________________
MW|481.0
Formula|C25H21ClN2O4S
CAS_number|
PubChem|91754975
UniChem|JDJXOOKBURTXCO-IBGZPJMESA-N
IUPHAR|
Wikipedia|

Target
Families | 5ALG-R4N ligand of proteins in family: Epoxide_hydrolase
Stucture | 1 structure: 5ALG: ligand complex structure of soluble epoxide hydrolase
Protein | human-EPHX2

References:
Search PubMed for references concerning: 5ALG-R4N
    Title: Successful generation of structural information for fragment-based drug discovery
    Oster L, Tapani S, Xue Y, Kack H
    Ref: Drug Discov Today, 20:1104, 2015 : PubMed