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canSAR78732
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NAMES
    SMILES
    CC#CCn1c(N2CCCC(N)C2)nc2c(OC)nn(Cc3cccc4ccccc34)c(=O)c21
    InChI
    InChI=1S/C26H28N6O2/c1-3-4-15-31-23-22(28-26(31)30-14-8-12-20(27)17-30)24(34-2)29-32(25(23)33)16-19-11-7-10-18-9-5-6-13-21(18)19/h5-7,9-11,13,20H,8,12,14-17,27H2,1-2H3
    MOLECULAR FORMULA
    C26H28N6O2
    CROSS REFERENCES
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    canSAR78732

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 456.23
    AlogP 2.75
    HBond donors 2
    HBond acceptors 8
    Atoms 62
    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 canSAR78732.