canSAR423935
FEATURES
Loading...
NAMES
    SMILES
    COc1cc(CNC(=S)NCC(COC(=O)C(C)(C)C)Cc2ccc(C)c(C)c2)cc(I)c1O
    InChI
    InChI=1S/C26H35IN2O4S/c1-16-7-8-18(9-17(16)2)10-20(15-33-24(31)26(3,4)5)14-29-25(34)28-13-19-11-21(27)23(30)22(12-19)32-6/h7-9,11-12,20,30H,10,13-15H2,1-6H3,(H2,28,29,34)
    MOLECULAR FORMULA
    C26H35IN2O4S
    CROSS REFERENCES
    Loading...
    canSAR423935
    Compound Synopsis
    OVERVIEW
    PROPERTIES
    Molecular weight598.14
    AlogP5.03
    HBond donors3
    HBond acceptors6
    Atoms69
    Contains toxicophoreYes
    Contains PAINSNo
    Commercially availableUnknown
    Property color indications are based on Lipinski's Ro5.
    PROTEIN TARGETS
    No information about proteins targeted by canSAR423935.