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canSAR1687345
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NAMES
    SMILES
    COc1cccc(-c2nc(NCc3cccnc3)c3ccccc3n2)c1O
    InChI
    InChI=1S/C21H18N4O2/c1-27-18-10-4-8-16(19(18)26)21-24-17-9-3-2-7-15(17)20(25-21)23-13-14-6-5-11-22-12-14/h2-12,26H,13H2,1H3,(H,23,24,25)
    MOLECULAR FORMULA
    C21H18N4O2
    CROSS REFERENCES
    1687345 logo

    canSAR1687345

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 358.14
    AlogP 4.02
    HBond donors 2
    HBond acceptors 6
    Atoms 45
    Contains toxicophore No
    Contains PAINS No
    Commercially available Yes
    Property color indications are based on Lipinski's Ro5.
    PROTEIN TARGETS
    No information about proteins targeted by canSAR1687345.