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Yorodumi- ChemComp-2VN: 2-[(4-{2-[(4-cyclohexylbutyl)(cyclohexylcarbamoyl)amino]ethyl}phe... -
+Open data
-Basic information
Entry | Database: PDB chemical components / ID: 2VN |
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Name | Name: |
-Chemical information
Composition | Formula: C29H46N2O3S / Number of atoms: 81 / Formula weight: 502.752 / Formal charge: 0 | ||||
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Others | 2ml0 | ||||
History |
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External links | UniChem / BindingDB / ChEBI / ChEMBL / ChemicalBook / CompTox / GtoPharmacology / HMDB / KEGG_Ligand / Nikkaji / PubChem / PubChem_TPharma / SureChEMBL / 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 1.7.6 | |
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-SMILES CANONICAL
CACTVS 3.385 | OpenEye OEToolkits 1.7.6 | |
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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 1.7.6 | |
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-PDB entries
Showing all 5 items
PDB-6drg:
NMR solution structure of wild type hFABP1 with GW7647
PDB-6kay:
X-ray structure of human PPARalpha ligand binding domain-GW7647 co-crystals obtained by soaking
PDB-6kb3:
X-ray structure of human PPARalpha ligand binding domain-GW7647 co-crystals obtained by delipidation and cross-seeding
PDB-6kb8:
X-ray structure of human PPARalpha ligand binding domain-GW7647 co-crystals obtained by cross-seeding
PDB-7bq3:
X-ray structure of human PPARalpha ligand binding domain-GW7647-SRC1 coactivator peptide co-crystals obtained by delipidation and co-crystallization