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canSAR830529
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NAMES
    SMILES
    CCOc1cc2ncc(C#N)c(Nc3ccc(F)c(Cl)c3)c2cc1NC(=O)/C=C/CN(C)CCF
    InChI
    InChI=1S/C25H24ClF2N5O2/c1-3-35-23-13-21-18(12-22(23)32-24(34)5-4-9-33(2)10-8-27)25(16(14-29)15-30-21)31-17-6-7-20(28)19(26)11-17/h4-7,11-13,15H,3,8-10H2,1-2H3,(H,30,31)(H,32,34)/b5-4+
    MOLECULAR FORMULA
    C25H24ClF2N5O2
    CROSS REFERENCES
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    canSAR830529

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 499.16
    AlogP 5.44
    HBond donors 2
    HBond acceptors 7
    Atoms 59
    Contains toxicophore Yes
    Contains PAINS No
    Commercially available Unknown
    Property color indications are based on Lipinski's Ro5.
    PROTEIN TARGETS
    No information about proteins targeted by canSAR830529.