canSAR604197
FEATURES
Loading...
NAMES
    SMILES
    COc1ccc(CN2CCN(c3c(Br)cnc4[nH]c(-c5ccc(N6CCOCC6)cc5)nc34)CC2)cn1
    InChI
    InChI=1S/C27H30BrN7O2/c1-36-23-7-2-19(16-29-23)18-33-8-10-35(11-9-33)25-22(28)17-30-27-24(25)31-26(32-27)20-3-5-21(6-4-20)34-12-14-37-15-13-34/h2-7,16-17H,8-15,18H2,1H3,(H,30,31,32)
    MOLECULAR FORMULA
    C27H30BrN7O2
    CROSS REFERENCES
    Loading...
    canSAR604197
    Compound Synopsis
    OVERVIEW
    PROPERTIES
    Molecular weight563.16
    AlogP3.95
    HBond donors1
    HBond acceptors9
    Atoms67
    Contains toxicophoreNo
    Contains PAINSYes
    Commercially availableUnknown
    Property color indications are based on Lipinski's Ro5.
    PROTEIN TARGETS
    No information about proteins targeted by canSAR604197.