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canSAR1103181
FEATURES
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NAMES
    SMILES
    COc1cc(-c2cc(Cl)ccc2Oc2ccc(S(=O)(=O)Nc3nccs3)cc2C#N)n(C)n1
    InChI
    InChI=1S/C21H16ClN5O4S2/c1-27-17(11-20(25-27)30-2)16-10-14(22)3-5-19(16)31-18-6-4-15(9-13(18)12-23)33(28,29)26-21-24-7-8-32-21/h3-11H,1-2H3,(H,24,26)
    MOLECULAR FORMULA
    C21H16ClN5O4S2
    CROSS REFERENCES
    1103181 logo

    canSAR1103181

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 501.03
    AlogP 4.67
    HBond donors 1
    HBond acceptors 9
    Atoms 49
    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 canSAR1103181.