canSAR2095966
FEATURES
Loading...
NAMES
    SMILES
    C=C[C@H]1CN2CC[C@H]1C[C@@H]2[C@H](OCc1cn(Cc2ccccc2)nn1)c1ccnc2ccc(OC)cc12
    InChI
    InChI=1S/C30H33N5O2/c1-3-22-18-34-14-12-23(22)15-29(34)30(26-11-13-31-28-10-9-25(36-2)16-27(26)28)37-20-24-19-35(33-32-24)17-21-7-5-4-6-8-21/h3-11,13,16,19,22-23,29-30H,1,12,14-15,17-18,20H2,2H3/t22-,23-,29+,30+/m0/s1
    MOLECULAR FORMULA
    C30H33N5O2
    CROSS REFERENCES
    Loading...
    canSAR2095966
    Compound Synopsis
    OVERVIEW
    PROPERTIES
    Molecular weight495.26
    AlogP5.04
    HBond donors0
    HBond acceptors7
    Atoms70
    Contains toxicophoreNo
    Contains PAINSNo
    Commercially availableUnknown
    Property color indications are based on Lipinski's Ro5.
    PROTEIN TARGETS
    No information about proteins targeted by canSAR2095966.