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canSAR1986717
FEATURES
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NAMES
    SMILES
    COc1cccc2cc(C(=O)Nc3ccc(S(=O)(=O)NCC4CCCO4)cc3)c(=O)oc12
    InChI
    InChI=1S/C22H22N2O7S/c1-29-19-6-2-4-14-12-18(22(26)31-20(14)19)21(25)24-15-7-9-17(10-8-15)32(27,28)23-13-16-5-3-11-30-16/h2,4,6-10,12,16,23H,3,5,11,13H2,1H3,(H,24,25)
    MOLECULAR FORMULA
    C22H22N2O7S
    CROSS REFERENCES
    1986717 logo

    canSAR1986717

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 458.11
    AlogP 2.51
    HBond donors 2
    HBond acceptors 9
    Atoms 54
    Contains toxicophore No
    Contains PAINS No
    Commercially available Yes
    Property color indications are based on Lipinski's Ro5.
    PROTEIN TARGETS
    No information about proteins targeted by canSAR1986717.