canSAR2080454
FEATURES
Loading...
NAMES
    SMILES
    C[C@@H](Nc1ncnc2ccc(NC(=O)Nc3ccc(CN4CCN(C)CC4)cc3)cc12)c1ccccc1
    InChI
    InChI=1S/C29H33N7O/c1-21(23-6-4-3-5-7-23)32-28-26-18-25(12-13-27(26)30-20-31-28)34-29(37)33-24-10-8-22(9-11-24)19-36-16-14-35(2)15-17-36/h3-13,18,20-21H,14-17,19H2,1-2H3,(H,30,31,32)(H2,33,34,37)/t21-/m1/s1
    MOLECULAR FORMULA
    C29H33N7O
    CROSS REFERENCES
    Loading...
    canSAR2080454
    Compound Synopsis
    OVERVIEW
    PROPERTIES
    Molecular weight495.27
    AlogP5.19
    HBond donors3
    HBond acceptors8
    Atoms70
    Contains toxicophoreNo
    Contains PAINSNo
    Commercially availableUnknown
    Property color indications are based on Lipinski's Ro5.
    PROTEIN TARGETS
    No information about proteins targeted by canSAR2080454.