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- ChemComp-KFC: ~{N}-cyclopentyl-6-methyl-4-phenylazanyl-quinoline-2-carboxamide -

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Basic information

EntryDatabase: PDB chemical components / ID: KFC
NameName: ~{N}-cyclopentyl-6-methyl-4-phenylazanyl-quinoline-2-carboxamide

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Chemical information

Composition
Formula: C22H23N3O / Number of atoms: 49 / Formula weight: 345.438 / Formal charge: 0
Others

7zyj

Type: non-polymer / PDB classification: HETAIN / Three letter code: KFC / Ideal coordinates details: Corina / Model coordinates PDB-ID: 7ZYJ
History
Create componentMay 25, 2022
Modify descriptorAug 22, 2022
Initial releaseSep 28, 2022
External linksUniChem / ChemSpider / Wikipedia search / Google search

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Structure visualization

Structure viewerMolecule:
MolmilJmol/JSmol

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Details

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SMILES

CACTVS 3.385Cc1ccc2nc(cc(Nc3ccccc3)c2c1)C(=O)NC4CCCC4
OpenEye OEToolkits 2.0.7Cc1ccc2c(c1)c(cc(n2)C(=O)NC3CCCC3)Nc4ccccc4

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SMILES CANONICAL

CACTVS 3.385Cc1ccc2nc(cc(Nc3ccccc3)c2c1)C(=O)NC4CCCC4
OpenEye OEToolkits 2.0.7Cc1ccc2c(c1)c(cc(n2)C(=O)NC3CCCC3)Nc4ccccc4

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InChI

InChI 1.06InChI=1S/C22H23N3O/c1-15-11-12-19-18(13-15)20(23-16-7-3-2-4-8-16)14-21(25-19)22(26)24-17-9-5-6-10-17/h2-4,7-8,11-14,17H,5-6,9-10H2,1H3,(H,23,25)(H,24,26)

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InChIKey

InChI 1.06YSFGQDYFFHGWOC-UHFFFAOYSA-N

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PDB entries

Showing all 1 items

PDB-7zyj:
Leishmania tarentolae proteasome 20S subunit in complex with compound 2

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