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canSAR733202
FEATURES
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NAMES
    SMILES
    COCCOCOc1c(C/C=C(\C)CCC(=O)OC)c(OC(=O)c2cccnc2)c(C)c2c1C(=O)OC2
    InChI
    InChI=1S/C27H31NO9/c1-17(8-10-22(29)33-4)7-9-20-24(37-26(30)19-6-5-11-28-14-19)18(2)21-15-35-27(31)23(21)25(20)36-16-34-13-12-32-3/h5-7,11,14H,8-10,12-13,15-16H2,1-4H3/b17-7+
    MOLECULAR FORMULA
    C27H31NO9
    CROSS REFERENCES
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    canSAR733202

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 513.20
    AlogP 3.72
    HBond donors 0
    HBond acceptors 10
    Atoms 68
    Contains toxicophore Yes
    Contains PAINS No
    Commercially available Unknown
    Property color indications are based on Lipinski's Ro5.
    PROTEIN TARGETS
    No information about proteins targeted by canSAR733202.