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canSAR2020405
FEATURES
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NAMES
    SMILES
    CC[N+](CC)(CC#Cc1ccccc1)CC#Cc1ccccc1.[Br-]
    InChI
    InChI=1S/C22H24N.BrH/c1-3-23(4-2,19-11-17-21-13-7-5-8-14-21)20-12-18-22-15-9-6-10-16-22;/h5-10,13-16H,3-4,19-20H2,1-2H3;1H/q+1;/p-1
    MOLECULAR FORMULA
    C22H24BrN
    CROSS REFERENCES
    2020405 logo

    canSAR2020405

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 381.11
    AlogP 0.95
    HBond donors 0
    HBond acceptors 1
    Atoms 48
    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 canSAR2020405.