canSAR2080561
FEATURES
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NAMES
    SMILES
    COc1cc(CNC(=O)CCCCCCCc2ccccc2)ccc1B(O)O
    InChI
    InChI=1S/C22H30BNO4/c1-28-21-16-19(14-15-20(21)23(26)27)17-24-22(25)13-9-4-2-3-6-10-18-11-7-5-8-12-18/h5,7-8,11-12,14-16,26-27H,2-4,6,9-10,13,17H2,1H3,(H,24,25)
    MOLECULAR FORMULA
    C22H30BNO4
    CROSS REFERENCES
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    canSAR2080561
    Compound Synopsis
    OVERVIEW
    PROPERTIES
    Molecular weight383.23
    AlogP2.57
    HBond donors3
    HBond acceptors5
    Atoms58
    Contains toxicophoreYes
    Contains PAINSNo
    Commercially availableUnknown
    Property color indications are based on Lipinski's Ro5.
    PROTEIN TARGETS
    No information about proteins targeted by canSAR2080561.