canSAR604259
FEATURES
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NAMES
    SMILES
    Fc1cncc(CN2CCN(c3c(Br)cnc4[nH]c(-c5ccc(CN6CCNCC6)cc5)nc34)CC2)c1
    InChI
    InChI=1S/C27H30BrFN8/c28-23-16-32-27-24(25(23)37-11-9-36(10-12-37)18-20-13-22(29)15-31-14-20)33-26(34-27)21-3-1-19(2-4-21)17-35-7-5-30-6-8-35/h1-4,13-16,30H,5-12,17-18H2,(H,32,33,34)
    MOLECULAR FORMULA
    C27H30BrFN8
    CROSS REFERENCES
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    canSAR604259
    Compound Synopsis
    OVERVIEW
    PROPERTIES
    Molecular weight564.18
    AlogP3.65
    HBond donors2
    HBond acceptors8
    Atoms67
    Contains toxicophoreNo
    Contains PAINSNo
    Commercially availableUnknown
    Property color indications are based on Lipinski's Ro5.
    PROTEIN TARGETS
    No information about proteins targeted by canSAR604259.