[English] 日本語
Yorodumi- ChemComp-LS8: 4-cyano-~{N}-(1,3-dimethyl-2-oxidanylidene-quinolin-6-yl)-2-metho... -
+Open data
-Basic information
Entry | Database: PDB chemical components / ID: LS8 |
---|---|
Name | Name: |
-Chemical information
Composition | Formula: C19H17N3O4S / Number of atoms: 44 / Formula weight: 383.421 / Formal charge: 0 | ||||
---|---|---|---|---|---|
Others | Type: NON-POLYMER / PDB classification: HETAIN / Three letter code: LS8 / Ideal coordinates details: Corina / Model coordinates PDB-ID: 5MYG | ||||
History |
| ||||
External links | UniChem / BindingDB / ChEMBL / ChemicalBook / GtoPharmacology / PubChem / SureChEMBL / ZINC / ChemSpider / 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 1 items
PDB-5myg:
Crystal structure of the bromodomain of human BRPF1 in complex with NI-57 chemical probe