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Yorodumi- ChemComp-CT9: 4-[5-(TRANS-4-AMINOCYCLOHEXYLAMINO)-3-ISOPROPYLPYRAZOLO[1,5-A]PYR... -
+Open data
-Basic information
Entry | Database: PDB chemical components / ID: CT9 |
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Name | Name: |
-Chemical information
Composition | Formula: C23H33N7O2S / Number of atoms: 66 / Formula weight: 471.619 / Formal charge: 0 | ||||
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Others | Type: NON-POLYMER / PDB classification: HETAIN / Three letter code: CT9 / Model coordinates PDB-ID: 1Y91 | ||||
History |
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External links | BindingDB / UniChem / ChEMBL / DrugBank / PubChem_TPharma / SureChEMBL / ChemSpider / Wikipedia search / Google search |
-Structure visualization
Structure viewer | Molecule: MolmilJmol/JSmol |
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-Details
-SMILES
ACDLabs 10.04 | CACTVS 3.341 | OpenEye OEToolkits 1.5.0 | |
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-SMILES CANONICAL
CACTVS 3.341 | OpenEye OEToolkits 1.5.0 | |
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-InChI
InChI 1.03 |
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-InChIKey
InChI 1.03 |
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-SYSTEMATIC NAME
ACDLabs 10.04 | OpenEye OEToolkits 1.5.0 | |
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-PDB entries
Showing all 1 items
PDB-1y91:
Crystal structure of human CDK2 complexed with a pyrazolo[1,5-a]pyrimidine inhibitor