2050985 logo
canSAR2050985
FEATURES
Loading...
avatar
avatar
avatar
avatar
avatar
avatar
avatar
avatar
avatar
avatar
avatar
NAMES
    SMILES
    COc1ccccc1N1CCN(c2ncnc3c2cnn3-c2cccc(C#N)c2)CC1
    InChI
    InChI=1S/C23H21N7O/c1-31-21-8-3-2-7-20(21)28-9-11-29(12-10-28)22-19-15-27-30(23(19)26-16-25-22)18-6-4-5-17(13-18)14-24/h2-8,13,15-16H,9-12H2,1H3
    MOLECULAR FORMULA
    C23H21N7O
    CROSS REFERENCES
    2050985 logo

    canSAR2050985

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 411.18
    AlogP 3.02
    HBond donors 0
    HBond acceptors 8
    Atoms 52
    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 canSAR2050985.