canSAR1646575
FEATURES
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NAMES
    SMILES
    CC1CC(C)CN(c2ccc([N+](=O)[O-])nc2)C1
    InChI
    InChI=1S/C12H17N3O2/c1-9-5-10(2)8-14(7-9)11-3-4-12(13-6-11)15(16)17/h3-4,6,9-10H,5,7-8H2,1-2H3
    MOLECULAR FORMULA
    C12H17N3O2
    CROSS REFERENCES
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    canSAR1646575
    Compound Synopsis
    OVERVIEW
    PROPERTIES
    Molecular weight235.13
    AlogP2.47
    HBond donors0
    HBond acceptors5
    Atoms34
    Contains toxicophoreNo
    Contains PAINSNo
    Commercially availableYes
    Property color indications are based on Lipinski's Ro5.
    PROTEIN TARGETS
    No information about proteins targeted by canSAR1646575.