[English] 日本語
Yorodumi- ChemComp-7MA: N-ethyl-2-[(6-methoxypyridin-3-yl)-(2-methylphenyl)sulfonyl-amino... -
+Open data
-Basic information
Entry | Database: PDB chemical components / ID: 7MA | ||
---|---|---|---|
Name | Name: Comment | antagonist*YM | |
-Chemical information
Composition | Formula: C23H26N4O4S / Number of atoms: 58 / Formula weight: 454.542 / Formal charge: 0 | ||||
---|---|---|---|---|---|
Others | Type: NON-POLYMER / PDB classification: HETAIN / Three letter code: 7MA / Ideal coordinates details: Corina / Model coordinates PDB-ID: 5WQC | ||||
History |
| ||||
External links | UniChem / ChemSpider / BindingDB / ChEMBL / ChemicalBook / GtoPharmacology / PubChem / PubChem_TPharma / SureChEMBL / ZINC / Wikipedia search / Google search |
-Structure visualization
Structure viewer | Molecule: MolmilJmol/JSmol |
---|
-Details
-SMILES
CACTVS 3.385 | OpenEye OEToolkits 2.0.6 | |
---|
-SMILES CANONICAL
CACTVS 3.385 | OpenEye OEToolkits 2.0.6 | |
---|
-InChI
InChI 1.03 |
---|
-InChIKey
InChI 1.03 |
---|
-SYSTEMATIC NAME
OpenEye OEToolkits 2.0.6 | ~{ |
---|
-PDB entries
Showing all 4 items
PDB-5wqc:
Crystal structure of human orexin 2 receptor bound to the selective antagonist EMPA determined by the synchrotron light source at SPring-8.
PDB-5ws3:
Crystal structures of human orexin 2 receptor bound to the selective antagonist EMPA determined by serial femtosecond crystallography at SACLA
PDB-6tod:
Crystal structure of the Orexin-1 receptor in complex with EMPA
PDB-6tpg:
Crystal structure of the Orexin-2 receptor in complex with EMPA at 2.74 A resolution