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canSAR1638535
FEATURES
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NAMES
    SMILES
    COc1cccc(CNC(=O)c2cccnc2Sc2ccc(C)cc2C)c1
    InChI
    InChI=1S/C22H22N2O2S/c1-15-9-10-20(16(2)12-15)27-22-19(8-5-11-23-22)21(25)24-14-17-6-4-7-18(13-17)26-3/h4-13H,14H2,1-3H3,(H,24,25)
    MOLECULAR FORMULA
    C22H22N2O2S
    CROSS REFERENCES
    1638535 logo

    canSAR1638535

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 378.14
    AlogP 4.79
    HBond donors 1
    HBond acceptors 4
    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 canSAR1638535.