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canSAR1529166
FEATURES
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NAMES
    SMILES
    COc1ccc(S(=O)(=O)Nc2ccc3c(c2)CC(=O)N([C@H](C)CO)C[C@@H](C)[C@H](CN(C)Cc2ccc4c(c2)OCO4)O3)cc1
    InChI
    InChI=1S/C32H39N3O8S/c1-21-16-35(22(2)19-36)32(37)15-24-14-25(33-44(38,39)27-9-7-26(40-4)8-10-27)6-12-28(24)43-31(21)18-34(3)17-23-5-11-29-30(13-23)42-20-41-29/h5-14,21-22,31,33,36H,15-20H2,1-4H3/t21-,22-,31+/m1/s1
    MOLECULAR FORMULA
    C32H39N3O8S
    CROSS REFERENCES
    1529166 logo

    canSAR1529166

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 625.25
    AlogP 3.51
    HBond donors 2
    HBond acceptors 11
    Atoms 83
    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 canSAR1529166.