canSAR633806
FEATURES
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NAMES
    SMILES
    NC1=CN2c3ccccc3N(CC(=O)N3CCOCC3)C2C=C1
    InChI
    InChI=1S/C17H20N4O2/c18-13-5-6-16-20(11-13)14-3-1-2-4-15(14)21(16)12-17(22)19-7-9-23-10-8-19/h1-6,11,16H,7-10,12,18H2
    MOLECULAR FORMULA
    C17H20N4O2
    CROSS REFERENCES
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    canSAR633806
    Compound Synopsis
    OVERVIEW
    PROPERTIES
    Molecular weight312.16
    AlogP0.87
    HBond donors2
    HBond acceptors6
    Atoms43
    Contains toxicophoreNo
    Contains PAINSYes
    Commercially availableUnknown
    Property color indications are based on Lipinski's Ro5.
    PROTEIN TARGETS
    No information about proteins targeted by canSAR633806.