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canSAR656787
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NAMES
    SMILES
    Cc1ccc(OCC(=O)Nc2cc(B3OC(C)(C)C(C)(C)O3)ccc2O)cc1
    InChI
    InChI=1S/C21H26BNO5/c1-14-6-9-16(10-7-14)26-13-19(25)23-17-12-15(8-11-18(17)24)22-27-20(2,3)21(4,5)28-22/h6-12,24H,13H2,1-5H3,(H,23,25)
    MOLECULAR FORMULA
    C21H26BNO5
    CROSS REFERENCES
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    canSAR656787

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 383.19
    AlogP 3.02
    HBond donors 2
    HBond acceptors 6
    Atoms 54
    Contains toxicophore Yes
    Contains PAINS No
    Commercially available Unknown
    Property color indications are based on Lipinski's Ro5.
    PROTEIN TARGETS
    No information about proteins targeted by canSAR656787.