canSAR2096034
FEATURES
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NAMES
    SMILES
    O=S(=O)(Nc1ccc(F)c(Nc2ncccc2-c2ncnc3[nH]cnc23)c1F)C1CCOCC1
    InChI
    InChI=1S/C21H19F2N7O3S/c22-14-3-4-15(30-34(31,32)12-5-8-33-9-6-12)16(23)18(14)29-20-13(2-1-7-24-20)17-19-21(27-10-25-17)28-11-26-19/h1-4,7,10-12,30H,5-6,8-9H2,(H,24,29)(H,25,26,27,28)
    MOLECULAR FORMULA
    C21H19F2N7O3S
    CROSS REFERENCES
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    canSAR2096034
    Compound Synopsis
    OVERVIEW
    PROPERTIES
    Molecular weight487.12
    AlogP3.36
    HBond donors3
    HBond acceptors10
    Atoms53
    Contains toxicophoreNo
    Contains PAINSNo
    Commercially availableUnknown
    Property color indications are based on Lipinski's Ro5.
    PROTEIN TARGETS
    No information about proteins targeted by canSAR2096034.