canSAR164455
FEATURES
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NAMES
    SMILES
    O=C(NC12CC3CC(CC(C3)C1)C2)N[C@H]1CC[C@H](Oc2ccc([N+](=O)[O-])cc2)CC1
    InChI
    InChI=1S/C23H31N3O4/c27-22(25-23-12-15-9-16(13-23)11-17(10-15)14-23)24-18-1-5-20(6-2-18)30-21-7-3-19(4-8-21)26(28)29/h3-4,7-8,15-18,20H,1-2,5-6,9-14H2,(H2,24,25,27)/t15?,16?,17?,18-,20-,23?
    MOLECULAR FORMULA
    C23H31N3O4
    CROSS REFERENCES
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    canSAR164455
    Compound Synopsis
    OVERVIEW
    PROPERTIES
    Molecular weight413.23
    AlogP4.55
    HBond donors2
    HBond acceptors7
    Atoms61
    Contains toxicophoreYes
    Contains PAINSNo
    Commercially availableUnknown
    Property color indications are based on Lipinski's Ro5.
    PROTEIN TARGETS
    No information about proteins targeted by canSAR164455.