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Yorodumi- ChemComp-E7W: (1~{R},2~{S})-2-[[4-[[3-(aminomethyl)phenyl]amino]quinazolin-2-yl... -
+Open data
-Basic information
Entry | Database: PDB chemical components / ID: E7W |
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Name | Name: ( |
-Chemical information
Composition | Formula: C22H25N5O2 / Number of atoms: 54 / Formula weight: 391.466 / Formal charge: 0 | ||||
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Others | Type: NON-POLYMER / PDB classification: HETAIN / Three letter code: E7W / Ideal coordinates details: Corina / Model coordinates PDB-ID: 6FUI | ||||
History |
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External links | UniChem / BindingDB / Brenda / ChEMBL / PubChem / ChemSpider / Wikipedia search / Google search |
-Structure visualization
Structure viewer | Molecule: MolmilJmol/JSmol |
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-Details
-SMILES
CACTVS 3.385 | OpenEye OEToolkits 2.0.6 | |
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-SMILES CANONICAL
CACTVS 3.385 | OpenEye OEToolkits 2.0.6 | |
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-InChI
InChI 1.03 |
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-InChIKey
InChI 1.03 |
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-SYSTEMATIC NAME
OpenEye OEToolkits 2.0.6 | ( |
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-PDB entries
Showing all 1 items
PDB-6fui:
Complement factor D in complex with the inhibitor 3-((3-((3-(aminomethyl)phenyl)amino)-1H-pyrazolo[3,4-d]pyrimidin-4-yl)amino)phenol