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canSAR1719126
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NAMES
    SMILES
    O=P(Nc1nccs1)(c1ccccc1)c1nc2ccccc2s1
    InChI
    InChI=1S/C16H12N3OPS2/c20-21(12-6-2-1-3-7-12,19-15-17-10-11-22-15)16-18-13-8-4-5-9-14(13)23-16/h1-11H,(H,17,19,20)
    MOLECULAR FORMULA
    C16H12N3OPS2
    CROSS REFERENCES
    1719126 logo

    canSAR1719126

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 357.02
    AlogP 4.09
    HBond donors 1
    HBond acceptors 4
    Atoms 35
    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 canSAR1719126.