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canSAR1636423
FEATURES
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NAMES
    SMILES
    COc1ccccc1NC(=O)CN1CCC(n2c(C)nc3cc(F)ccc32)CC1
    InChI
    InChI=1S/C22H25FN4O2/c1-15-24-19-13-16(23)7-8-20(19)27(15)17-9-11-26(12-10-17)14-22(28)25-18-5-3-4-6-21(18)29-2/h3-8,13,17H,9-12,14H2,1-2H3,(H,25,28)
    MOLECULAR FORMULA
    C22H25FN4O2
    CROSS REFERENCES
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    canSAR1636423

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 396.20
    AlogP 3.77
    HBond donors 1
    HBond acceptors 6
    Atoms 54
    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 canSAR1636423.