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canSAR1268053
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NAMES
    SMILES
    Clc1ccc(C(CC2CNC2)Oc2ccccc2Cl)cc1Cl
    InChI
    InChI=1S/C17H16Cl3NO/c18-13-6-5-12(8-15(13)20)17(7-11-9-21-10-11)22-16-4-2-1-3-14(16)19/h1-6,8,11,17,21H,7,9-10H2
    MOLECULAR FORMULA
    C17H16Cl3NO
    CROSS REFERENCES
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    canSAR1268053

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 355.03
    AlogP 5.38
    HBond donors 1
    HBond acceptors 2
    Atoms 38
    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 canSAR1268053.