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canSAR101693
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NAMES
    SMILES
    O=C(Nc1ccccc1)c1cccnc1[S+]([O-])C(c1ccccc1)c1ccccc1
    InChI
    InChI=1S/C25H20N2O2S/c28-24(27-21-15-8-3-9-16-21)22-17-10-18-26-25(22)30(29)23(19-11-4-1-5-12-19)20-13-6-2-7-14-20/h1-18,23H,(H,27,28)
    MOLECULAR FORMULA
    C25H20N2O2S
    CROSS REFERENCES
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    canSAR101693

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 412.12
    AlogP 5.23
    HBond donors 1
    HBond acceptors 4
    Atoms 50
    Contains toxicophore No
    Contains PAINS No
    Commercially available Unknown
    Property color indications are based on Lipinski's Ro5.
    PROTEIN TARGETS
    No information about proteins targeted by canSAR101693.