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canSAR1508346
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NAMES
    SMILES
    CN1CCN(C(=O)c2ccc3c(c2)[nH]c2c(C(N)=O)ccc(-c4cccc(NC(=O)c5ccc(N(C)C)cc5)c4F)c23)CC1
    InChI
    InChI=1S/C34H33FN6O3/c1-39(2)22-10-7-20(8-11-22)33(43)38-27-6-4-5-24(30(27)35)23-13-14-26(32(36)42)31-29(23)25-12-9-21(19-28(25)37-31)34(44)41-17-15-40(3)16-18-41/h4-14,19,37H,15-18H2,1-3H3,(H2,36,42)(H,38,43)
    MOLECULAR FORMULA
    C34H33FN6O3
    CROSS REFERENCES
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    canSAR1508346

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 592.26
    AlogP 4.93
    HBond donors 4
    HBond acceptors 9
    Atoms 77
    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 canSAR1508346.