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canSAR1951224
FEATURES
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NAMES
    SMILES
    COc1ccc(CCNc2nc(SCc3ccccc3F)nc3ccccc23)cc1OC
    InChI
    InChI=1S/C25H24FN3O2S/c1-30-22-12-11-17(15-23(22)31-2)13-14-27-24-19-8-4-6-10-21(19)28-25(29-24)32-16-18-7-3-5-9-20(18)26/h3-12,15H,13-14,16H2,1-2H3,(H,27,28,29)
    MOLECULAR FORMULA
    C25H24FN3O2S
    CROSS REFERENCES
    1951224 logo

    canSAR1951224

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 449.16
    AlogP 5.73
    HBond donors 1
    HBond acceptors 5
    Atoms 56
    Contains toxicophore No
    Contains PAINS No
    Commercially available Unknown
    Property color indications are based on Lipinski's Ro5.
    PROTEIN TARGETS
    No information about proteins targeted by canSAR1951224.