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canSAR1965935
FEATURES
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NAMES
    SMILES
    Cc1c(Cc2ccc3c(c2)OCCO3)cc([C@@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O)c2c1CCC2
    InChI
    InChI=1S/C25H30O7/c1-13-15(9-14-5-6-19-20(10-14)31-8-7-30-19)11-18(17-4-2-3-16(13)17)25-24(29)23(28)22(27)21(12-26)32-25/h5-6,10-11,21-29H,2-4,7-9,12H2,1H3/t21-,22-,23+,24-,25+/m1/s1
    MOLECULAR FORMULA
    C25H30O7
    CROSS REFERENCES
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    canSAR1965935

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 442.20
    AlogP 1.36
    HBond donors 4
    HBond acceptors 7
    Atoms 62
    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 canSAR1965935.