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canSAR1013268
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NAMES
    SMILES
    Cc1ccc2[nH]c3c(c2c1)CCCc1c[nH]nc1-3
    InChI
    InChI=1S/C15H15N3/c1-9-5-6-13-12(7-9)11-4-2-3-10-8-16-18-14(10)15(11)17-13/h5-8,17H,2-4H2,1H3,(H,16,18)
    MOLECULAR FORMULA
    C15H15N3
    CROSS REFERENCES
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    canSAR1013268

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 237.13
    AlogP 3.36
    HBond donors 2
    HBond acceptors 3
    Atoms 33
    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 canSAR1013268.