+Open data
-Basic information
Entry | Database: PDB chemical components / ID: K94 | ||
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Name | Name: Wikipedia | Wikipedia - NV-5138: NV-5138 is an orally and centrally active small-molecule drug which is under development by Navitor Pharmaceuticals for the treatment of major depressive disorder (MDD). It directly and selectively activates the mammalian target of rapamycin complex 1 (mTORC1) signaling pathway by binding to and modulating sestrin2, a leucine amino acid sensor and upstream regulatory pathway... | |
-Chemical information
Composition | Formula: C7H13F2NO2 / Number of atoms: 25 / Formula weight: 181.18 / Formal charge: 0 | ||||
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Others | Type: NON-POLYMER / PDB classification: HETAIN / Three letter code: K94 / Ideal coordinates details: Corina / Model coordinates PDB-ID: 6N0M | ||||
History |
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External links | UniChem / ChEMBL / ChemicalBook / PubChem / 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 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
ACDLabs 12.01 | OpenEye OEToolkits 2.0.6 | ( | |
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-PDB entries
Showing all 1 items
PDB-6n0m:
CRYSTAL STRUCTURE OF SESTRIN2 IN COMPLEX WITH NV-0005138