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canSAR1132694
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NAMES
    SMILES
    Nc1ccc(/C=C/c2nc3ccc([125I])cc3[nH]2)cc1
    InChI
    InChI=1S/C15H12IN3/c16-11-4-7-13-14(9-11)19-15(18-13)8-3-10-1-5-12(17)6-2-10/h1-9H,17H2,(H,18,19)/b8-3+/i16-2
    MOLECULAR FORMULA
    C15H12IN3
    CROSS REFERENCES
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    canSAR1132694

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 359.01
    AlogP 3.92
    HBond donors 3
    HBond acceptors 3
    Atoms 31
    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 canSAR1132694.