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canSAR1428753
FEATURES
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NAMES
    SMILES
    CCN1CCC(CC(NC(=O)c2ccc([N+](=O)[O-])cc2)c2ccc(F)cc2)CC1
    InChI
    InChI=1S/C22H26FN3O3/c1-2-25-13-11-16(12-14-25)15-21(17-3-7-19(23)8-4-17)24-22(27)18-5-9-20(10-6-18)26(28)29/h3-10,16,21H,2,11-15H2,1H3,(H,24,27)
    MOLECULAR FORMULA
    C22H26FN3O3
    CROSS REFERENCES
    1428753 logo

    canSAR1428753

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 399.20
    AlogP 4.33
    HBond donors 1
    HBond acceptors 6
    Atoms 55
    Contains toxicophore No
    Contains PAINS No
    Commercially available Unknown
    Property color indications are based on Lipinski's Ro5.
    PROTEIN TARGETS
    No information about proteins targeted by canSAR1428753.