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Yorodumi- ChemComp-OD4: 4-{5-[(3-aminopropyl)carbamoyl]thiophen-2-yl}-1-benzothiophene-2-... -
+Open data
-Basic information
Entry | Database: PDB chemical components / ID: OD4 |
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Name | Name: |
-Chemical information
Composition | Formula: C17H16N2O3S2 / Number of atoms: 40 / Formula weight: 360.451 / Formal charge: 0 | ||||||||
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Others | Type: NON-POLYMER / PDB classification: HETAIN / Three letter code: OD4 / Ideal coordinates details: Corina / Model coordinates PDB-ID: 6PDN | ||||||||
History |
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External links | UniChem / ChemSpider / PubChem / Wikipedia search / Google search |
-Structure visualization
Structure viewer | Molecule: MolmilJmol/JSmol |
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-Details
-SMILES
ACDLabs 12.01 | CACTVS 3.385 | OpenEye OEToolkits 2.0.7 | |
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-SMILES CANONICAL
CACTVS 3.385 | OpenEye OEToolkits 2.0.7 | |
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-InChI
InChI 1.03 |
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-InChIKey
InChI 1.03 |
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-SYSTEMATIC NAME
ACDLabs 12.01 | OpenEye OEToolkits 2.0.7 | |
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-PDB entries
Showing all 1 items
PDB-6pdn:
Human PIM1 bound to benzothiophene inhibitor 292