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canSAR845313
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NAMES
    SMILES
    CN1C(=O)C[C@H](c2ccccc2)[C@@H]1[C@H](O)c1ccc(-c2cccnc2)s1
    InChI
    InChI=1S/C21H20N2O2S/c1-23-19(24)12-16(14-6-3-2-4-7-14)20(23)21(25)18-10-9-17(26-18)15-8-5-11-22-13-15/h2-11,13,16,20-21,25H,12H2,1H3/t16-,20-,21-/m1/s1
    MOLECULAR FORMULA
    C21H20N2O2S
    CROSS REFERENCES
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    canSAR845313

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 364.12
    AlogP 3.86
    HBond donors 1
    HBond acceptors 4
    Atoms 46
    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 canSAR845313.