canSAR2095849
FEATURES
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NAMES
    SMILES
    CC(=O)OC[C@H]1O[C@@H](n2cc(CN3C(=O)/C(=C\C=C\c4ccccc4)c4ccccc43)nn2)[C@H](OC(C)=O)[C@@H](OC(C)=O)[C@@H]1OC(C)=O
    InChI
    InChI=1S/C34H34N4O10/c1-20(39)44-19-29-30(45-21(2)40)31(46-22(3)41)32(47-23(4)42)34(48-29)38-18-25(35-36-38)17-37-28-16-9-8-14-26(28)27(33(37)43)15-10-13-24-11-6-5-7-12-24/h5-16,18,29-32,34H,17,19H2,1-4H3/b13-10+,27-15-/t29-,30-,31+,32-,34-/m1/s1
    MOLECULAR FORMULA
    C34H34N4O10
    CROSS REFERENCES
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    canSAR2095849
    Compound Synopsis
    OVERVIEW
    PROPERTIES
    Molecular weight658.23
    AlogP3.18
    HBond donors0
    HBond acceptors14
    Atoms82
    Contains toxicophoreYes
    Contains PAINSNo
    Commercially availableUnknown
    Property color indications are based on Lipinski's Ro5.
    PROTEIN TARGETS
    No information about proteins targeted by canSAR2095849.