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canSAR561602
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NAMES
    SMILES
    C[n+]1c2ccccc2c(-c2ccccc2)c2[nH]c3ccccc3c21
    InChI
    InChI=1S/C22H16N2/c1-24-19-14-8-6-12-17(19)20(15-9-3-2-4-10-15)21-22(24)16-11-5-7-13-18(16)23-21/h2-14H,1H3/p+1
    MOLECULAR FORMULA
    C22H17N2+
    CROSS REFERENCES
    561602 logo

    canSAR561602

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 309.14
    AlogP 4.97
    HBond donors 1
    HBond acceptors 2
    Atoms 41
    Contains toxicophore No
    Contains PAINS Yes
    Commercially available Unknown
    Property color indications are based on Lipinski's Ro5.
    PROTEIN TARGETS
    No information about proteins targeted by canSAR561602.