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canSAR2050469
FEATURES
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NAMES
    SMILES
    COc1cc2c(c(OC)c1OC)-c1c(cc3c(c1OC)OCO3)C[C@H](C)[C@](C)(O)[C@H]2OC(=O)c1ccc(C)c(F)c1
    InChI
    InChI=1S/C31H33FO9/c1-15-8-9-17(11-20(15)32)30(33)41-29-19-13-21(35-4)25(36-5)28(38-7)24(19)23-18(10-16(2)31(29,3)34)12-22-26(27(23)37-6)40-14-39-22/h8-9,11-13,16,29,34H,10,14H2,1-7H3/t16-,29-,31-/m0/s1
    MOLECULAR FORMULA
    C31H33FO9
    CROSS REFERENCES
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    canSAR2050469

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 568.21
    AlogP 5.41
    HBond donors 1
    HBond acceptors 9
    Atoms 74
    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 canSAR2050469.