canSAR858097
FEATURES
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NAMES
    SMILES
    C[N+]1(C)CCC[C@H]1c1ccc([C@@](O)(c2ccccc2)C2CCCCC2)o1.[I-]
    InChI
    InChI=1S/C23H32NO2.HI/c1-24(2)17-9-14-20(24)21-15-16-22(26-21)23(25,18-10-5-3-6-11-18)19-12-7-4-8-13-19;/h3,5-6,10-11,15-16,19-20,25H,4,7-9,12-14,17H2,1-2H3;1H/q+1;/p-1/t20-,23+;/m0./s1
    MOLECULAR FORMULA
    C23H32INO2
    CROSS REFERENCES
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    canSAR858097
    Compound Synopsis
    OVERVIEW
    PROPERTIES
    Molecular weight481.15
    AlogP2.01
    HBond donors1
    HBond acceptors3
    Atoms59
    Contains toxicophoreNo
    Contains PAINSNo
    Commercially availableUnknown
    Property color indications are based on Lipinski's Ro5.
    PROTEIN TARGETS
    No information about proteins targeted by canSAR858097.