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canSAR1064306
FEATURES
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NAMES
    SMILES
    O=C(NCCC(O)CO)c1ccc(F)c(F)c1Nc1ccc(I)cc1F
    InChI
    InChI=1S/C17H16F3IN2O3/c18-12-3-2-11(17(26)22-6-5-10(25)8-24)16(15(12)20)23-14-4-1-9(21)7-13(14)19/h1-4,7,10,23-25H,5-6,8H2,(H,22,26)
    MOLECULAR FORMULA
    C17H16F3IN2O3
    CROSS REFERENCES
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    canSAR1064306

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 480.02
    AlogP 2.93
    HBond donors 4
    HBond acceptors 5
    Atoms 42
    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 canSAR1064306.