canSAR823829
FEATURES
Loading...
NAMES
    SMILES
    C[C@H](CCC(=O)NCCc1ccc(S(N)(=O)=O)cc1)[C@H]1CC[C@H]2C3C(=O)C[C@@H]4CC(=O)CC[C@]4(C)[C@H]3CC(=O)[C@@]21C
    InChI
    InChI=1S/C32H44N2O6S/c1-19(4-11-29(38)34-15-13-20-5-7-23(8-6-20)41(33,39)40)24-9-10-25-30-26(18-28(37)32(24,25)3)31(2)14-12-22(35)16-21(31)17-27(30)36/h5-8,19,21,24-26,30H,4,9-18H2,1-3H3,(H,34,38)(H2,33,39,40)/t19-,21+,24-,25+,26+,30?,31+,32-/m1/s1
    MOLECULAR FORMULA
    C32H44N2O6S
    CROSS REFERENCES
    Loading...
    canSAR823829
    Compound Synopsis
    OVERVIEW
    PROPERTIES
    Molecular weight584.29
    AlogP4.00
    HBond donors3
    HBond acceptors8
    Atoms85
    Contains toxicophoreYes
    Contains PAINSNo
    Commercially availableUnknown
    Property color indications are based on Lipinski's Ro5.
    PROTEIN TARGETS
    No information about proteins targeted by canSAR823829.