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canSAR50058
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NAMES
    SMILES
    N#Cc1nc(NCc2cccc(-c3ccc4ccccc4c3)c2)c2ncn(CCCO)c2n1
    InChI
    InChI=1S/C26H22N6O/c27-15-23-30-25(24-26(31-23)32(17-29-24)11-4-12-33)28-16-18-5-3-8-20(13-18)22-10-9-19-6-1-2-7-21(19)14-22/h1-3,5-10,13-14,17,33H,4,11-12,16H2,(H,28,30,31)
    MOLECULAR FORMULA
    C26H22N6O
    CROSS REFERENCES
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    canSAR50058

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 434.19
    AlogP 4.51
    HBond donors 2
    HBond acceptors 7
    Atoms 55
    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 canSAR50058.