canSAR544132
FEATURES
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NAMES
    SMILES
    CC(C)c1cccc(C(C)C)c1-n1cc[n+](CC(=O)c2ccc3ccccc3c2)c1.[Br-]
    InChI
    InChI=1S/C27H29N2O.BrH/c1-19(2)24-10-7-11-25(20(3)4)27(24)29-15-14-28(18-29)17-26(30)23-13-12-21-8-5-6-9-22(21)16-23;/h5-16,18-20H,17H2,1-4H3;1H/q+1;/p-1
    MOLECULAR FORMULA
    C27H29BrN2O
    CROSS REFERENCES
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    canSAR544132
    Compound Synopsis
    OVERVIEW
    PROPERTIES
    Molecular weight476.15
    AlogP3.05
    HBond donors0
    HBond acceptors3
    Atoms60
    Contains toxicophoreNo
    Contains PAINSNo
    Commercially availableUnknown
    Property color indications are based on Lipinski's Ro5.
    PROTEIN TARGETS
    No information about proteins targeted by canSAR544132.