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canSAR2047994
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NAMES
    SMILES
    COc1ccc([C@H](C)[C@@H](OC(C)=O)c2ccc3c(c2OC)C=CC(C)(C)O3)c(F)c1OC
    InChI
    InChI=1S/C25H29FO6/c1-14(16-8-11-20(28-5)24(30-7)21(16)26)22(31-15(2)27)18-9-10-19-17(23(18)29-6)12-13-25(3,4)32-19/h8-14,22H,1-7H3/t14-,22+/m0/s1
    MOLECULAR FORMULA
    C25H29FO6
    CROSS REFERENCES
    2047994 logo

    canSAR2047994

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 444.19
    AlogP 5.44
    HBond donors 0
    HBond acceptors 6
    Atoms 61
    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 canSAR2047994.