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canSAR1717465
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NAMES
    SMILES
    C=CCC(C#Cc1ccccc1)[N+](C)(C)CC=C.[Br-]
    InChI
    InChI=1S/C17H22N.BrH/c1-5-10-17(18(3,4)15-6-2)14-13-16-11-8-7-9-12-16;/h5-9,11-12,17H,1-2,10,15H2,3-4H3;1H/q+1;/p-1
    MOLECULAR FORMULA
    C17H22BrN
    CROSS REFERENCES
    1717465 logo

    canSAR1717465

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 319.09
    AlogP 0.25
    HBond donors 0
    HBond acceptors 1
    Atoms 41
    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 canSAR1717465.