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canSAR1532214
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NAMES
    SMILES
    O=S(=O)(O)c1cc(N=Nc2cccc(B(O)O)c2)c(O)c2ccccc12
    InChI
    InChI=1S/C16H13BN2O6S/c20-16-13-7-2-1-6-12(13)15(26(23,24)25)9-14(16)19-18-11-5-3-4-10(8-11)17(21)22/h1-9,20-22H,(H,23,24,25)
    MOLECULAR FORMULA
    C16H13BN2O6S
    CROSS REFERENCES
    1532214 logo

    canSAR1532214

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 372.06
    AlogP 1.89
    HBond donors 4
    HBond acceptors 8
    Atoms 39
    Contains toxicophore Yes
    Contains PAINS Yes
    Commercially available Unknown
    Property color indications are based on Lipinski's Ro5.
    PROTEIN TARGETS
    No information about proteins targeted by canSAR1532214.