+Open data
-Basic information
Entry | Database: PDB chemical components / ID: TIC | ||
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Name | Name: Synonyms: 5-(2-chlorobenzyl)-4,5,6,7-tetrahydrothieno[3,2-c]pyridine Comment | medication, inhibitor*YM | |
-Chemical information
Composition | Formula: C14H14ClNS / Number of atoms: 31 / Formula weight: 263.786 / Formal charge: 0 | ||||||||
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Others | Type: NON-POLYMER / PDB classification: HETAD / Three letter code: TIC / Ideal coordinates details: Corina / Model coordinates PDB-ID: 3KW4 | ||||||||
History |
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External links | UniChem / ChemSpider / BindingDB / Brenda / ChEBI / ChEMBL / ChemicalBook / CompTox / DailyMed / DrugBank / GtoPharmacology / HMDB / KEGG_Ligand / Nikkaji / PubChem / PubChem_TPharma / SureChEMBL / ZINC / Wikipedia search / Google search |
-Structure visualization
Structure viewer | Molecule: MolmilJmol/JSmol |
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-Details
-SMILES
ACDLabs 12.01 | CACTVS 3.370 | OpenEye OEToolkits 1.7.0 | |
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-SMILES CANONICAL
CACTVS 3.370 | OpenEye OEToolkits 1.7.0 | |
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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 1.7.0 | ( | |
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-PDB entries
Showing all 1 items
PDB-3kw4:
Crystal structure of cytochrome 2B4 in complex with the anti-platelet drug ticlopidine