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canSAR2281744
FEATURES
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NAMES
    SMILES
    CC(C)Oc1cccnc1N(C)C1CCN(Cc2ccc(I)cc2)CC1
    InChI
    InChI=1S/C21H28IN3O/c1-16(2)26-20-5-4-12-23-21(20)24(3)19-10-13-25(14-11-19)15-17-6-8-18(22)9-7-17/h4-9,12,16,19H,10-11,13-15H2,1-3H3
    MOLECULAR FORMULA
    C21H28IN3O
    CROSS REFERENCES
    2281744 logo

    canSAR2281744

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 465.13
    AlogP 4.57
    HBond donors 0
    HBond acceptors 4
    Atoms 54
    Contains toxicophore No
    Contains PAINS No
    Commercially available Unknown
    Property color indications are based on Lipinski's Ro5.
    PROTEIN TARGETS
    No information about proteins targeted by canSAR2281744.