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canSAR1633844
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NAMES
    SMILES
    CO[C@H]1CCN(c2nc(-c3c(C)ccc4[nH]nc(C)c34)nc3c2CN(c2c(F)c(C4CC4)nn2C)CC3)CC1(C)C
    InChI
    InChI=1S/C31H39FN8O/c1-17-7-10-22-25(18(2)35-36-22)24(17)28-33-21-11-13-39(30-26(32)27(19-8-9-19)37-38(30)5)15-20(21)29(34-28)40-14-12-23(41-6)31(3,4)16-40/h7,10,19,23H,8-9,11-16H2,1-6H3,(H,35,36)/t23-/m0/s1
    MOLECULAR FORMULA
    C31H39FN8O
    CROSS REFERENCES
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    canSAR1633844

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 558.32
    AlogP 5.20
    HBond donors 1
    HBond acceptors 9
    Atoms 80
    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 canSAR1633844.