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canSAR164641
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NAMES
    SMILES
    c1cc(OCCCc2nnn[nH]2)cc(OCc2cnc3ccccc3c2)c1
    InChI
    InChI=1S/C20H19N5O2/c1-2-8-19-16(5-1)11-15(13-21-19)14-27-18-7-3-6-17(12-18)26-10-4-9-20-22-24-25-23-20/h1-3,5-8,11-13H,4,9-10,14H2,(H,22,23,24,25)
    MOLECULAR FORMULA
    C20H19N5O2
    CROSS REFERENCES
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    canSAR164641

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 361.15
    AlogP 3.34
    HBond donors 1
    HBond acceptors 7
    Atoms 46
    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 canSAR164641.