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canSAR671117
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NAMES
    SMILES
    COc1cc(NCc2ccccc2)c2ncn(Cc3ccccc3)c2c1
    InChI
    InChI=1S/C22H21N3O/c1-26-19-12-20(23-14-17-8-4-2-5-9-17)22-21(13-19)25(16-24-22)15-18-10-6-3-7-11-18/h2-13,16,23H,14-15H2,1H3
    MOLECULAR FORMULA
    C22H21N3O
    CROSS REFERENCES
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    canSAR671117

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 343.17
    AlogP 4.71
    HBond donors 1
    HBond acceptors 4
    Atoms 47
    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 canSAR671117.