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Yorodumi- ChemComp-9IG: 3-(2-chlorophenyl)-N-[(1R)-1-(3-methoxyphenyl)ethyl]propan-1-amine -
+Open data
-Basic information
Entry | Database: PDB chemical components / ID: 9IG |
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Name | Name: |
-Chemical information
Composition | Formula: C18H22ClNO / Number of atoms: 43 / Formula weight: 303.826 / Formal charge: 0 | ||||
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Others | Type: non-polymer / PDB classification: HETAIN / Three letter code: 9IG / Ideal coordinates details: Corina / Model coordinates PDB-ID: 7SIL | ||||
History |
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External links | UniChem / ChemSpider / BindingDB / ChEMBL / CompTox / GtoPharmacology / 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 3.385 | 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 6 items
PDB-7sil:
Structure of positive allosteric modulator-bound active human calcium-sensing receptor
PDB-9asb:
Structure of human calcium-sensing receptor in complex with chimeric Gq (miniGisq) protein in nanodiscs
PDB-9avg:
Structure of human calcium-sensing receptor in complex with chimeric Gs (miniGis) protein in nanodiscs
PDB-9avl:
Structure of human calcium-sensing receptor in complex with Gi3 protein in nanodiscs
PDB-9axf:
Structure of human calcium-sensing receptor in complex with chimeric Gq (miniGisq) protein in detergent
PDB-9ayf:
Structure of human calcium-sensing receptor in complex with Gi1 (miniGi1) protein in detergent