canSAR2181055
FEATURES
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NAMES
    SMILES
    C[C@@H]1C(=O)[C@H](C)[C@H](Nc2ccccc2O)[C@@H](C)[C@@H](c2cc(O)cc(O)c2)OC(=O)[C@H](C)[C@@H]1O
    InChI
    InChI=1S/C25H31NO7/c1-12-21(26-19-7-5-6-8-20(19)29)13(2)24(16-9-17(27)11-18(28)10-16)33-25(32)15(4)23(31)14(3)22(12)30/h5-15,21,23-24,26-29,31H,1-4H3/t12-,13-,14-,15-,21+,23-,24+/m1/s1
    MOLECULAR FORMULA
    C25H31NO7
    CROSS REFERENCES
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    canSAR2181055
    Compound Synopsis
    OVERVIEW
    PROPERTIES
    Molecular weight457.21
    AlogP3.36
    HBond donors5
    HBond acceptors8
    Atoms64
    Contains toxicophoreYes
    Contains PAINSNo
    Commercially availableUnknown
    Property color indications are based on Lipinski's Ro5.
    PROTEIN TARGETS
    No information about proteins targeted by canSAR2181055.