1638244 logo
canSAR1638244
FEATURES
Loading...
avatar
avatar
avatar
avatar
avatar
avatar
avatar
avatar
avatar
avatar
avatar
NAMES
    SMILES
    COc1ccc(S(=O)(=O)N(C)C[C@@H]2Oc3ccc(NC(=O)C4CCCCC4)cc3CC(=O)N([C@@H](C)CO)C[C@@H]2C)cc1
    InChI
    InChI=1S/C31H43N3O7S/c1-21-18-34(22(2)20-35)30(36)17-24-16-25(32-31(37)23-8-6-5-7-9-23)10-15-28(24)41-29(21)19-33(3)42(38,39)27-13-11-26(40-4)12-14-27/h10-16,21-23,29,35H,5-9,17-20H2,1-4H3,(H,32,37)/t21-,22-,29-/m0/s1
    MOLECULAR FORMULA
    C31H43N3O7S
    CROSS REFERENCES
    1638244 logo

    canSAR1638244

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 601.28
    AlogP 3.68
    HBond donors 2
    HBond acceptors 10
    Atoms 85
    Contains toxicophore No
    Contains PAINS No
    Commercially available Unknown
    Property color indications are based on Lipinski's Ro5.
    PROTEIN TARGETS
    No information about proteins targeted by canSAR1638244.