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canSAR561105
FEATURES
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NAMES
    SMILES
    C[n+]1c2ccccc2cc2[nH]c3ccccc3c21
    InChI
    InChI=1S/C16H12N2/c1-18-15-9-5-2-6-11(15)10-14-16(18)12-7-3-4-8-13(12)17-14/h2-10H,1H3/p+1
    MOLECULAR FORMULA
    C16H13N2+
    CROSS REFERENCES
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    canSAR561105

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 233.11
    AlogP 3.30
    HBond donors 1
    HBond acceptors 2
    Atoms 31
    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 canSAR561105.