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canSAR1114316
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NAMES
    SMILES
    CC(C)(C)c1nc2ccc(-c3ccsc3)nn2c1-c1cccc(-c2cccc(O)c2)c1
    InChI
    InChI=1S/C26H23N3OS/c1-26(2,3)25-24(19-8-4-6-17(14-19)18-7-5-9-21(30)15-18)29-23(27-25)11-10-22(28-29)20-12-13-31-16-20/h4-16,30H,1-3H3
    MOLECULAR FORMULA
    C26H23N3OS
    CROSS REFERENCES
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    canSAR1114316

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 425.16
    AlogP 6.79
    HBond donors 1
    HBond acceptors 4
    Atoms 54
    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 canSAR1114316.