canSAR1632269
FEATURES
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NAMES
    SMILES
    CC(C)Oc1cccc(C(=O)NC(=S)N2CCN(c3ccc(C(F)(F)F)cc3[N+](=O)[O-])CC2)c1
    InChI
    InChI=1S/C22H23F3N4O4S/c1-14(2)33-17-5-3-4-15(12-17)20(30)26-21(34)28-10-8-27(9-11-28)18-7-6-16(22(23,24)25)13-19(18)29(31)32/h3-7,12-14H,8-11H2,1-2H3,(H,26,30,34)
    MOLECULAR FORMULA
    C22H23F3N4O4S
    CROSS REFERENCES
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    canSAR1632269
    Compound Synopsis
    OVERVIEW
    PROPERTIES
    Molecular weight496.14
    AlogP4.24
    HBond donors1
    HBond acceptors8
    Atoms57
    Contains toxicophoreYes
    Contains PAINSNo
    Commercially availableYes
    Property color indications are based on Lipinski's Ro5.
    PROTEIN TARGETS
    No information about proteins targeted by canSAR1632269.