canSAR163179
FEATURES
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NAMES
    SMILES
    COc1cc2nc3c(cc2c(CN2CCCC2)c1O)CSc1cc(F)ccc1-3
    InChI
    InChI=1S/C22H21FN2O2S/c1-27-19-10-18-16(17(22(19)26)11-25-6-2-3-7-25)8-13-12-28-20-9-14(23)4-5-15(20)21(13)24-18/h4-5,8-10,26H,2-3,6-7,11-12H2,1H3
    MOLECULAR FORMULA
    C22H21FN2O2S
    CROSS REFERENCES
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    canSAR163179
    Compound Synopsis
    OVERVIEW
    PROPERTIES
    Molecular weight396.13
    AlogP4.96
    HBond donors1
    HBond acceptors4
    Atoms49
    Contains toxicophoreNo
    Contains PAINSYes
    Commercially availableUnknown
    Property color indications are based on Lipinski's Ro5.
    PROTEIN TARGETS
    No information about proteins targeted by canSAR163179.