canSAR739521
FEATURES
Loading...
NAMES
    SMILES
    COc1ccc(N2CCN(c3nc(Nc4cc(C(C)(C)C)ccc4C)c4c(ncn4CC(F)(F)F)n3)CC2(C)C)cc1
    InChI
    InChI=1S/C31H38F3N7O/c1-20-8-9-21(29(2,3)4)16-24(20)36-27-25-26(35-19-40(25)18-31(32,33)34)37-28(38-27)39-14-15-41(30(5,6)17-39)22-10-12-23(42-7)13-11-22/h8-13,16,19H,14-15,17-18H2,1-7H3,(H,36,37,38)
    MOLECULAR FORMULA
    C31H38F3N7O
    CROSS REFERENCES
    Loading...
    canSAR739521
    Compound Synopsis
    OVERVIEW
    PROPERTIES
    Molecular weight581.31
    AlogP6.85
    HBond donors1
    HBond acceptors8
    Atoms80
    Contains toxicophoreNo
    Contains PAINSYes
    Commercially availableUnknown
    Property color indications are based on Lipinski's Ro5.
    PROTEIN TARGETS
    No information about proteins targeted by canSAR739521.