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canSAR3495
FEATURES
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NAMES
    SMILES
    CCCS(=O)(=O)N1N=Cc2sccc2B1O
    InChI
    InChI=1S/C8H11BN2O3S2/c1-2-5-16(13,14)11-9(12)7-3-4-15-8(7)6-10-11/h3-4,6,12H,2,5H2,1H3
    MOLECULAR FORMULA
    C8H11BN2O3S2
    CROSS REFERENCES
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    canSAR3495

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 258.03
    AlogP -0.18
    HBond donors 1
    HBond acceptors 5
    Atoms 27
    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 canSAR3495.