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canSAR1979800
FEATURES
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NAMES
    SMILES
    CNC(=O)Nc1ccc(Nc2c3ccccc3nc3ccccc23)c(C)c1.Cl
    InChI
    InChI=1S/C22H20N4O.ClH/c1-14-13-15(24-22(27)23-2)11-12-18(14)26-21-16-7-3-5-9-19(16)25-20-10-6-4-8-17(20)21;/h3-13H,1-2H3,(H,25,26)(H2,23,24,27);1H
    MOLECULAR FORMULA
    C22H21ClN4O
    CROSS REFERENCES
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    canSAR1979800

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 392.14
    AlogP 5.61
    HBond donors 3
    HBond acceptors 5
    Atoms 49
    Contains toxicophore No
    Contains PAINS Yes
    Commercially available Unknown
    Property color indications are based on Lipinski's Ro5.
    PROTEIN TARGETS
    No information about proteins targeted by canSAR1979800.