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canSAR785204
FEATURES
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NAMES
    SMILES
    COc1cccc(Sc2c(/C=C/[C@@H]3C[C@@H](O)CC(=O)O3)c(C3CC3)nc3ccc(F)cc23)c1
    InChI
    InChI=1S/C26H24FNO4S/c1-31-18-3-2-4-20(14-18)33-26-21(9-8-19-12-17(29)13-24(30)32-19)25(15-5-6-15)28-23-10-7-16(27)11-22(23)26/h2-4,7-11,14-15,17,19,29H,5-6,12-13H2,1H3/b9-8+/t17-,19-/m1/s1
    MOLECULAR FORMULA
    C26H24FNO4S
    CROSS REFERENCES
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    canSAR785204

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 465.14
    AlogP 5.49
    HBond donors 1
    HBond acceptors 5
    Atoms 57
    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 canSAR785204.