canSAR2168919
FEATURES
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NAMES
    SMILES
    CCCCc1n(Cc2ccc3ccccc3c2)c2ccccc2[n+]1Cc1ccc2ccccc2c1.[Br-]
    InChI
    InChI=1S/C33H31N2.BrH/c1-2-3-16-33-34(23-25-17-19-27-10-4-6-12-29(27)21-25)31-14-8-9-15-32(31)35(33)24-26-18-20-28-11-5-7-13-30(28)22-26;/h4-15,17-22H,2-3,16,23-24H2,1H3;1H/q+1;/p-1
    MOLECULAR FORMULA
    C33H31BrN2
    CROSS REFERENCES
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    canSAR2168919
    Compound Synopsis
    OVERVIEW
    PROPERTIES
    Molecular weight534.17
    AlogP4.68
    HBond donors0
    HBond acceptors2
    Atoms67
    Contains toxicophoreNo
    Contains PAINSNo
    Commercially availableUnknown
    Property color indications are based on Lipinski's Ro5.
    PROTEIN TARGETS
    No information about proteins targeted by canSAR2168919.