canSAR1387618
FEATURES
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NAMES
    SMILES
    Cc1n(C(c2ccccc2)c2cc3ccccc3o2)cc[n+]1CC(=O)c1ccccc1.[Br-]
    InChI
    InChI=1S/C27H23N2O2.BrH/c1-20-28(19-24(30)21-10-4-2-5-11-21)16-17-29(20)27(22-12-6-3-7-13-22)26-18-23-14-8-9-15-25(23)31-26;/h2-18,27H,19H2,1H3;1H/q+1;/p-1
    MOLECULAR FORMULA
    C27H23BrN2O2
    CROSS REFERENCES
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    canSAR1387618
    Compound Synopsis
    OVERVIEW
    PROPERTIES
    Molecular weight486.09
    AlogP2.35
    HBond donors0
    HBond acceptors4
    Atoms55
    Contains toxicophoreNo
    Contains PAINSNo
    Commercially availableUnknown
    Property color indications are based on Lipinski's Ro5.
    PROTEIN TARGETS
    No information about proteins targeted by canSAR1387618.