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canSAR1984734
FEATURES
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NAMES
    SMILES
    COc1ccc(C(=O)Nc2cccc(C(F)(F)F)c2)cc1Nc1ncnc2c(N)nc(N3CCN(CC4CCN(C)CC4)CC3)nc12
    InChI
    InChI=1S/C32H37F3N10O2/c1-43-10-8-20(9-11-43)18-44-12-14-45(15-13-44)31-41-27-26(28(36)42-31)37-19-38-29(27)40-24-16-21(6-7-25(24)47-2)30(46)39-23-5-3-4-22(17-23)32(33,34)35/h3-7,16-17,19-20H,8-15,18H2,1-2H3,(H,39,46)(H2,36,41,42)(H,37,38,40)
    MOLECULAR FORMULA
    C32H37F3N10O2
    CROSS REFERENCES
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    canSAR1984734

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 650.31
    AlogP 4.49
    HBond donors 4
    HBond acceptors 12
    Atoms 84
    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 canSAR1984734.