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canSAR1524811
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NAMES
    SMILES
    CC(C)N1CCc2c(sc(NC(=O)CCS(=O)(=O)c3ccccc3)c2C(N)=O)C1
    InChI
    InChI=1S/C20H25N3O4S2/c1-13(2)23-10-8-15-16(12-23)28-20(18(15)19(21)25)22-17(24)9-11-29(26,27)14-6-4-3-5-7-14/h3-7,13H,8-12H2,1-2H3,(H2,21,25)(H,22,24)
    MOLECULAR FORMULA
    C20H25N3O4S2
    CROSS REFERENCES
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    canSAR1524811

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 435.13
    AlogP 2.42
    HBond donors 3
    HBond acceptors 7
    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 canSAR1524811.