canSAR2257939
FEATURES
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NAMES
    SMILES
    CN1CCN(Cc2ccc(NC(=O)c3cccc(C#Cc4cncc5ccccc45)c3)cc2C(F)(F)F)CC1
    InChI
    InChI=1S/C31H27F3N4O/c1-37-13-15-38(16-14-37)21-26-11-12-27(18-29(26)31(32,33)34)36-30(39)23-7-4-5-22(17-23)9-10-25-20-35-19-24-6-2-3-8-28(24)25/h2-8,11-12,17-20H,13-16,21H2,1H3,(H,36,39)
    MOLECULAR FORMULA
    C31H27F3N4O
    CROSS REFERENCES
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    canSAR2257939
    Compound Synopsis
    OVERVIEW
    PROPERTIES
    Molecular weight528.21
    AlogP5.65
    HBond donors1
    HBond acceptors5
    Atoms66
    Contains toxicophoreNo
    Contains PAINSNo
    Commercially availableUnknown
    Property color indications are based on Lipinski's Ro5.
    PROTEIN TARGETS
    No information about proteins targeted by canSAR2257939.