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canSAR1531163
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NAMES
    SMILES
    CCOc1ccc([C@H]2c3[nH]c4ccccc4c3Cc3c(O)n(CCN(C)C)c(=O)n32)cc1
    InChI
    InChI=1S/C25H28N4O3/c1-4-32-17-11-9-16(10-12-17)23-22-19(18-7-5-6-8-20(18)26-22)15-21-24(30)28(14-13-27(2)3)25(31)29(21)23/h5-12,23,26,30H,4,13-15H2,1-3H3/t23-/m0/s1
    MOLECULAR FORMULA
    C25H28N4O3
    CROSS REFERENCES
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    canSAR1531163

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 432.22
    AlogP 3.34
    HBond donors 2
    HBond acceptors 7
    Atoms 60
    Contains toxicophore No
    Contains PAINS Yes
    Commercially available Unknown
    Property color indications are based on Lipinski's Ro5.
    PROTEIN TARGETS
    No information about proteins targeted by canSAR1531163.