canSAR1387143
FEATURES
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NAMES
    SMILES
    CCN1CCC2(CC1)CC(NC(=O)c1csnn1)c1ccccc1O2.O=C(O)C(F)(F)F
    InChI
    InChI=1S/C18H22N4O2S.C2HF3O2/c1-2-22-9-7-18(8-10-22)11-14(13-5-3-4-6-16(13)24-18)19-17(23)15-12-25-21-20-15;3-2(4,5)1(6)7/h3-6,12,14H,2,7-11H2,1H3,(H,19,23);(H,6,7)
    MOLECULAR FORMULA
    C20H23F3N4O4S
    CROSS REFERENCES
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    canSAR1387143
    Compound Synopsis
    OVERVIEW
    PROPERTIES
    Molecular weight472.14
    AlogP3.28
    HBond donors2
    HBond acceptors8
    Atoms55
    Contains toxicophoreYes
    Contains PAINSNo
    Commercially availableUnknown
    Property color indications are based on Lipinski's Ro5.
    PROTEIN TARGETS
    No information about proteins targeted by canSAR1387143.