[English] 日本語
Yorodumi- ChemComp-04R: [3-(trifluoromethyl)-4,5,6,7-tetrahydro-1H-indazol-1-yl]acetic acid -
+Open data
-Basic information
Entry | Database: PDB chemical components / ID: 04R |
---|---|
Name | Name: [ |
-Chemical information
Composition | Formula: C10H11F3N2O2 / Number of atoms: 28 / Formula weight: 248.202 / Formal charge: 0 | ||
---|---|---|---|
Others | Type: peptide linking / PDB classification: ATOMP / Three letter code: 04R / Ideal coordinates details: Corina / Model coordinates PDB-ID: 3O6G | ||
History |
| ||
External links | UniChem / ChEMBL / PubChem / SureChEMBL / ZINC / ChemSpider / Wikipedia search / Google search |
-Structure visualization
Structure viewer | Molecule: MolmilJmol/JSmol |
---|
-Details
-SMILES
ACDLabs 12.01 | CACTVS 3.370 | OpenEye OEToolkits 1.7.6 | |
---|
-SMILES CANONICAL
CACTVS 3.370 | OpenEye OEToolkits 1.7.6 | |
---|
-InChI
InChI 1.03 |
---|
-InChIKey
InChI 1.03 |
---|
-SYSTEMATIC NAME
ACDLabs 12.01 | [OpenEye OEToolkits 1.7.6 | |
---|
-PDB entries
Showing all 1 items
PDB-5rup:
PanDDA analysis group deposition -- Crystal structure of SARS-CoV-2 NSP3 macrodomain in complex with ZINC000004976927