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canSAR1859250
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NAMES
    SMILES
    CN1Cc2ccc(N3CCC(Oc4nc(-c5ccncn5)cc(=O)n4C)CC3)cc2C1
    InChI
    InChI=1S/C23H26N6O2/c1-27-13-16-3-4-18(11-17(16)14-27)29-9-6-19(7-10-29)31-23-26-21(12-22(30)28(23)2)20-5-8-24-15-25-20/h3-5,8,11-12,15,19H,6-7,9-10,13-14H2,1-2H3
    MOLECULAR FORMULA
    C23H26N6O2
    CROSS REFERENCES
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    canSAR1859250

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 418.21
    AlogP 2.23
    HBond donors 0
    HBond acceptors 8
    Atoms 57
    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 canSAR1859250.