canSAR1387054
FEATURES
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NAMES
    SMILES
    O=C(O)C(F)(F)F.O=C(c1cccs1)N1CCCC2(COCCN(c3cccnc3)C2)C1
    InChI
    InChI=1S/C19H23N3O2S.C2HF3O2/c23-18(17-5-2-11-25-17)22-8-3-6-19(14-22)13-21(9-10-24-15-19)16-4-1-7-20-12-16;3-2(4,5)1(6)7/h1-2,4-5,7,11-12H,3,6,8-10,13-15H2;(H,6,7)
    MOLECULAR FORMULA
    C21H24F3N3O4S
    CROSS REFERENCES
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    canSAR1387054
    Compound Synopsis
    OVERVIEW
    PROPERTIES
    Molecular weight471.14
    AlogP3.54
    HBond donors1
    HBond acceptors7
    Atoms56
    Contains toxicophoreYes
    Contains PAINSNo
    Commercially availableUnknown
    Property color indications are based on Lipinski's Ro5.
    PROTEIN TARGETS
    No information about proteins targeted by canSAR1387054.