canSAR2099026
FEATURES
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NAMES
    SMILES
    CC(C)CCOC(=O)C[C@H](NP(=O)(OC[C@H]1O[C@@H](n2cc(I)c(=O)[nH]c2=O)C[C@@H]1O)Oc1ccccc1)C(=O)OCCC(C)C
    InChI
    InChI=1S/C29H41IN3O11P/c1-18(2)10-12-40-26(35)14-22(28(37)41-13-11-19(3)4)32-45(39,44-20-8-6-5-7-9-20)42-17-24-23(34)15-25(43-24)33-16-21(30)27(36)31-29(33)38/h5-9,16,18-19,22-25,34H,10-15,17H2,1-4H3,(H,32,39)(H,31,36,38)/t22-,23-,24+,25+,45?/m0/s1
    MOLECULAR FORMULA
    C29H41IN3O11P
    CROSS REFERENCES
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    canSAR2099026
    Compound Synopsis
    OVERVIEW
    PROPERTIES
    Molecular weight765.15
    AlogP3.52
    HBond donors3
    HBond acceptors14
    Atoms86
    Contains toxicophoreYes
    Contains PAINSNo
    Commercially availableUnknown
    Property color indications are based on Lipinski's Ro5.
    PROTEIN TARGETS
    No information about proteins targeted by canSAR2099026.