canSAR1087482
FEATURES
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NAMES
    SMILES
    O=C(NCc1nccs1)c1ccc(N2CCN(C(=O)c3ccccc3C(F)(F)F)CC2)nn1
    InChI
    InChI=1S/C21H19F3N6O2S/c22-21(23,24)15-4-2-1-3-14(15)20(32)30-10-8-29(9-11-30)17-6-5-16(27-28-17)19(31)26-13-18-25-7-12-33-18/h1-7,12H,8-11,13H2,(H,26,31)
    MOLECULAR FORMULA
    C21H19F3N6O2S
    CROSS REFERENCES
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    canSAR1087482
    Compound Synopsis
    OVERVIEW
    PROPERTIES
    Molecular weight476.12
    AlogP2.84
    HBond donors1
    HBond acceptors8
    Atoms52
    Contains toxicophoreNo
    Contains PAINSNo
    Commercially availableUnknown
    Property color indications are based on Lipinski's Ro5.
    PROTEIN TARGETS
    No information about proteins targeted by canSAR1087482.