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canSAR658137
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NAMES
    SMILES
    CN1CCN(c2ccc(Cl)c(C(=O)Nc3ccc4c(c3)-c3c(c(C(N)=O)nn3-c3ccc(F)cc3)CC4)n2)CC1
    InChI
    InChI=1S/C29H27ClFN7O2/c1-36-12-14-37(15-13-36)24-11-10-23(30)26(34-24)29(40)33-19-6-2-17-3-9-21-25(28(32)39)35-38(27(21)22(17)16-19)20-7-4-18(31)5-8-20/h2,4-8,10-11,16H,3,9,12-15H2,1H3,(H2,32,39)(H,33,40)
    MOLECULAR FORMULA
    C29H27ClFN7O2
    CROSS REFERENCES
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    canSAR658137

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 559.19
    AlogP 3.93
    HBond donors 3
    HBond acceptors 9
    Atoms 67
    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 canSAR658137.