canSAR2160055
FEATURES
Loading...
NAMES
    SMILES
    COc1ccc(-n2nc(-n3cccc3CN3CCOCC3)c3c2C(=O)N(c2ccc(N4CCCCC4=O)cc2)CC3)cc1
    InChI
    InChI=1S/C33H36N6O4/c1-42-28-13-11-26(12-14-28)39-31-29(32(34-39)37-17-4-5-27(37)23-35-19-21-43-22-20-35)15-18-38(33(31)41)25-9-7-24(8-10-25)36-16-3-2-6-30(36)40/h4-5,7-14,17H,2-3,6,15-16,18-23H2,1H3
    MOLECULAR FORMULA
    C33H36N6O4
    CROSS REFERENCES
    Loading...
    canSAR2160055
    Compound Synopsis
    OVERVIEW
    PROPERTIES
    Molecular weight580.28
    AlogP4.22
    HBond donors0
    HBond acceptors10
    Atoms79
    Contains toxicophoreNo
    Contains PAINSNo
    Commercially availableUnknown
    Property color indications are based on Lipinski's Ro5.
    PROTEIN TARGETS
    No information about proteins targeted by canSAR2160055.