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Yorodumi- ChemComp-ORB: N-{(1R)-1-[4-(2-CHLORO-5-FLUOROPYRIDIN-3-YL)PHENYL]ETHYL}-3,5-DIM... -
+Open data
-Basic information
Entry | Database: PDB chemical components / ID: ORB |
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Name | Name: |
-Chemical information
Composition | Formula: C18H17ClFN3O3S / Number of atoms: 44 / Formula weight: 409.862 / Formal charge: 0 | ||||
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Others | Type: NON-POLYMER / PDB classification: HETAIN / Three letter code: ORB / Ideal coordinates details: Corina / Model coordinates PDB-ID: 3ZRA | ||||
History |
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External links | UniChem / PubChem / ZINC / ChemSpider / 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 1.9.2 | |
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-SMILES CANONICAL
CACTVS 3.385 | OpenEye OEToolkits 1.9.2 | |
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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 1.9.2 | |
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-PDB entries
Showing all 1 items
PDB-3zra:
Structural basis for agonism and antagonism for a set of chemically related progesterone receptor modulators