canSAR174622
FEATURES
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NAMES
    SMILES
    CC(=O)N1CCC2(CC1)NCc1cc(C(C)(C)C)cc(I)c1O2
    InChI
    InChI=1S/C18H25IN2O2/c1-12(22)21-7-5-18(6-8-21)20-11-13-9-14(17(2,3)4)10-15(19)16(13)23-18/h9-10,20H,5-8,11H2,1-4H3
    MOLECULAR FORMULA
    C18H25IN2O2
    CROSS REFERENCES
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    canSAR174622
    Compound Synopsis
    OVERVIEW
    PROPERTIES
    Molecular weight428.10
    AlogP3.41
    HBond donors1
    HBond acceptors4
    Atoms48
    Contains toxicophoreNo
    Contains PAINSNo
    Commercially availableUnknown
    Property color indications are based on Lipinski's Ro5.
    PROTEIN TARGETS
    No information about proteins targeted by canSAR174622.