canSAR2146417
FEATURES
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NAMES
    SMILES
    CN(C)Cc1cc(C(=O)N2CCC(N3CC(CC#N)(n4cc(-c5ncnc6[nH]ccc56)cn4)C3)CC2)c(F)c(C(F)(F)F)n1
    InChI
    InChI=1S/C29H30F4N10O/c1-40(2)14-19-11-22(23(30)25(39-19)29(31,32)33)27(44)41-9-4-20(5-10-41)42-15-28(16-42,6-7-34)43-13-18(12-38-43)24-21-3-8-35-26(21)37-17-36-24/h3,8,11-13,17,20H,4-6,9-10,14-16H2,1-2H3,(H,35,36,37)
    MOLECULAR FORMULA
    C29H30F4N10O
    CROSS REFERENCES
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    canSAR2146417
    Compound Synopsis
    OVERVIEW
    PROPERTIES
    Molecular weight610.25
    AlogP3.67
    HBond donors1
    HBond acceptors11
    Atoms74
    Contains toxicophoreNo
    Contains PAINSNo
    Commercially availableUnknown
    Property color indications are based on Lipinski's Ro5.
    PROTEIN TARGETS
    No information about proteins targeted by canSAR2146417.