canSAR1388163
FEATURES
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NAMES
    SMILES
    Cc1cc(=O)oc2cc(OCC[N+]3(C)CCCCC3C)ccc12.[I-]
    InChI
    InChI=1S/C19H26NO3.HI/c1-14-12-19(21)23-18-13-16(7-8-17(14)18)22-11-10-20(3)9-5-4-6-15(20)2;/h7-8,12-13,15H,4-6,9-11H2,1-3H3;1H/q+1;/p-1
    MOLECULAR FORMULA
    C19H26INO3
    CROSS REFERENCES
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    canSAR1388163
    Compound Synopsis
    OVERVIEW
    PROPERTIES
    Molecular weight443.10
    AlogP0.50
    HBond donors0
    HBond acceptors4
    Atoms50
    Contains toxicophoreNo
    Contains PAINSNo
    Commercially availableUnknown
    Property color indications are based on Lipinski's Ro5.
    PROTEIN TARGETS
    No information about proteins targeted by canSAR1388163.