canSAR1632014
FEATURES
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NAMES
    SMILES
    O=C(CCSc1nc(-c2ccco2)cc(C(F)(F)F)n1)Nc1ccc2c(c1)OCO2
    InChI
    InChI=1S/C19H14F3N3O4S/c20-19(21,22)16-9-12(13-2-1-6-27-13)24-18(25-16)30-7-5-17(26)23-11-3-4-14-15(8-11)29-10-28-14/h1-4,6,8-9H,5,7,10H2,(H,23,26)
    MOLECULAR FORMULA
    C19H14F3N3O4S
    CROSS REFERENCES
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    canSAR1632014
    Compound Synopsis
    OVERVIEW
    PROPERTIES
    Molecular weight437.07
    AlogP4.61
    HBond donors1
    HBond acceptors7
    Atoms44
    Contains toxicophoreNo
    Contains PAINSNo
    Commercially availableYes
    Property color indications are based on Lipinski's Ro5.
    PROTEIN TARGETS
    No information about proteins targeted by canSAR1632014.