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canSAR2088133
FEATURES
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NAMES
    SMILES
    C[N+]12CCC(CC1)C(NC(=O)c1ccc3cccnc3c1)C2.[I-]
    InChI
    InChI=1S/C18H21N3O.HI/c1-21-9-6-14(7-10-21)17(12-21)20-18(22)15-5-4-13-3-2-8-19-16(13)11-15;/h2-5,8,11,14,17H,6-7,9-10,12H2,1H3;1H
    MOLECULAR FORMULA
    C18H22IN3O
    CROSS REFERENCES
    2088133 logo

    canSAR2088133

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 423.08
    AlogP -0.79
    HBond donors 1
    HBond acceptors 4
    Atoms 45
    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 canSAR2088133.