canSAR206501
FEATURES
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NAMES
    SMILES
    CCOC(=O)Nc1nc(Cc2c(Cl)cccc2Cl)nc(Nc2ccc(C#N)cc2)n1
    InChI
    InChI=1S/C20H16Cl2N6O2/c1-2-30-20(29)28-19-26-17(10-14-15(21)4-3-5-16(14)22)25-18(27-19)24-13-8-6-12(11-23)7-9-13/h3-9H,2,10H2,1H3,(H2,24,25,26,27,28,29)
    MOLECULAR FORMULA
    C20H16Cl2N6O2
    CROSS REFERENCES
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    canSAR206501
    Compound Synopsis
    OVERVIEW
    PROPERTIES
    Molecular weight442.07
    AlogP4.95
    HBond donors2
    HBond acceptors8
    Atoms46
    Contains toxicophoreNo
    Contains PAINSNo
    Commercially availableUnknown
    Property color indications are based on Lipinski's Ro5.
    PROTEIN TARGETS
    No information about proteins targeted by canSAR206501.