canSAR163214
FEATURES
Loading...
NAMES
    SMILES
    CCCCCCCCCCCCCCCCCCNC(=O)[C@@H]1CSC(c2ccc(OC)cc2)N1
    InChI
    InChI=1S/C29H50N2O2S/c1-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-18-23-30-28(32)27-24-34-29(31-27)25-19-21-26(33-2)22-20-25/h19-22,27,29,31H,3-18,23-24H2,1-2H3,(H,30,32)/t27-,29?/m0/s1
    MOLECULAR FORMULA
    C29H50N2O2S
    CROSS REFERENCES
    Loading...
    canSAR163214
    Compound Synopsis
    OVERVIEW
    PROPERTIES
    Molecular weight490.36
    AlogP7.78
    HBond donors2
    HBond acceptors4
    Atoms84
    Contains toxicophoreYes
    Contains PAINSNo
    Commercially availableUnknown
    Property color indications are based on Lipinski's Ro5.
    PROTEIN TARGETS
    No information about proteins targeted by canSAR163214.