[English] 日本語
Yorodumi- ChemComp-88W: N~3~-(ethylcarbamoyl)-N-(2-methyl-1,3-benzothiazol-6-yl)-beta-ala... -
+Open data
-Basic information
Entry | Database: PDB chemical components / ID: 88W |
---|---|
Name | Name: Synonyms: 3-(ETHYLCARBAMOYLAMINO)-N-(2-METHYL-1,3-BENZOTHIAZOL-6- |
-Chemical information
Composition | Formula: C14H18N4O2S / Number of atoms: 39 / Formula weight: 306.383 / Formal charge: 0 | ||||||
---|---|---|---|---|---|---|---|
Others | Type: non-polymer / Three letter code: 88W / Ideal coordinates details: Corina / Model coordinates PDB-ID: 4AJL | ||||||
History |
| ||||||
External links | UniChem / ChemSpider / BindingDB / ChEMBL / PubChem / ZINC / Wikipedia search / Google search |
-Structure visualization
Structure viewer | Molecule: MolmilJmol/JSmol |
---|
-Details
-SMILES
ACDLabs 12.01 | CACTVS 3.385 | OpenEye OEToolkits 1.9.2 | |
---|
-SMILES CANONICAL
CACTVS 3.385 | OpenEye OEToolkits 1.9.2 | |
---|
-InChI
InChI 1.03 |
---|
-InChIKey
InChI 1.03 |
---|
-SYSTEMATIC NAME
ACDLabs 12.01 | OpenEye OEToolkits 1.9.2 | |
---|
-PDB entries
Showing all 1 items
PDB-4ajl:
rat LDHA in complex with 3-(ethylcarbamoylamino)-N-(2-methyl-1,3- benzothiazol-6-yl)propanamide