canSAR284223
FEATURES
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NAMES
    SMILES
    COC(=O)c1ccccc1C1c2ccc(N)cc2Oc2cc(N)c(I)cc21
    InChI
    InChI=1S/C21H17IN2O3/c1-26-21(25)13-5-3-2-4-12(13)20-14-7-6-11(23)8-18(14)27-19-10-17(24)16(22)9-15(19)20/h2-10,20H,23-24H2,1H3
    MOLECULAR FORMULA
    C21H17IN2O3
    CROSS REFERENCES
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    canSAR284223
    Compound Synopsis
    OVERVIEW
    PROPERTIES
    Molecular weight472.03
    AlogP4.53
    HBond donors4
    HBond acceptors5
    Atoms44
    Contains toxicophoreNo
    Contains PAINSYes
    Commercially availableUnknown
    Property color indications are based on Lipinski's Ro5.
    PROTEIN TARGETS
    No information about proteins targeted by canSAR284223.