canSAR2059683
FEATURES
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NAMES
    SMILES
    CCOC(=O)NC(=O)NC[C@H]1O[C@@H](n2cc(Cc3ccc(C4CC4)cc3)c3c(Cl)cccc32)[C@H](O)[C@@H](O)[C@@H]1O
    InChI
    InChI=1S/C28H32ClN3O7/c1-2-38-28(37)31-27(36)30-13-21-23(33)24(34)25(35)26(39-21)32-14-18(22-19(29)4-3-5-20(22)32)12-15-6-8-16(9-7-15)17-10-11-17/h3-9,14,17,21,23-26,33-35H,2,10-13H2,1H3,(H2,30,31,36,37)/t21-,23-,24+,25-,26-/m1/s1
    MOLECULAR FORMULA
    C28H32ClN3O7
    CROSS REFERENCES
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    canSAR2059683
    Compound Synopsis
    OVERVIEW
    PROPERTIES
    Molecular weight557.19
    AlogP3.20
    HBond donors5
    HBond acceptors10
    Atoms71
    Contains toxicophoreNo
    Contains PAINSNo
    Commercially availableUnknown
    Property color indications are based on Lipinski's Ro5.
    PROTEIN TARGETS
    No information about proteins targeted by canSAR2059683.