[English] 日本語
Yorodumi- ChemComp-QAQ: [(4-{2-[(3-hydroxyphenyl)amino]-1H-benzimidazol-1-yl}-1,3,5-triaz... -
+Open data
-Basic information
Entry | Database: PDB chemical components / ID: QAQ |
---|---|
Name | Name: [( Synonyms: 2-(4-(2-(3-hydroxyphenylamino)-1H-benzo[d]imidazol-1-yl)-1,3,5-triazin-2-ylamino)acetonitrile |
-Chemical information
Composition | Formula: C18H14N8O / Number of atoms: 41 / Formula weight: 358.357 / Formal charge: 0 | ||||||||
---|---|---|---|---|---|---|---|---|---|
Others | Type: NON-POLYMER / PDB classification: HETAIN / Three letter code: QAQ / Ideal coordinates details: Corina / Model coordinates PDB-ID: 3QAQ | ||||||||
History |
| ||||||||
External links | UniChem / BindingDB / Brenda / ChEMBL / PubChem / ZINC / ChemSpider / Wikipedia search / Google search |
-Structure visualization
Structure viewer | Molecule: MolmilJmol/JSmol |
---|
-Details
-SMILES
ACDLabs 12.01 | CACTVS 3.370 | OpenEye OEToolkits 1.7.0 | |
---|
-SMILES CANONICAL
CACTVS 3.370 | OpenEye OEToolkits 1.7.0 | |
---|
-InChI
InChI 1.03 |
---|
-InChIKey
InChI 1.03 |
---|
-SYSTEMATIC NAME
ACDLabs 12.01 | [(OpenEye OEToolkits 1.7.0 | |
---|
-PDB entries
Showing all 1 items
PDB-3qaq:
Crystal structure of PI3K-gamma in complex with triazine-benzimidazole 1