canSAR706357
FEATURES
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NAMES
    SMILES
    O=C(Nc1cccc2cc(S(=O)(=O)O)ccc12)c1cc(NC(=O)C2CCCCC2)cc(C(=O)Nc2cccc3cc(S(=O)(=O)O)ccc23)c1
    InChI
    InChI=1S/C35H31N3O9S2/c39-33(21-6-2-1-3-7-21)36-26-17-24(34(40)37-31-10-4-8-22-19-27(48(42,43)44)12-14-29(22)31)16-25(18-26)35(41)38-32-11-5-9-23-20-28(49(45,46)47)13-15-30(23)32/h4-5,8-21H,1-3,6-7H2,(H,36,39)(H,37,40)(H,38,41)(H,42,43,44)(H,45,46,47)
    MOLECULAR FORMULA
    C35H31N3O9S2
    CROSS REFERENCES
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    canSAR706357
    Compound Synopsis
    OVERVIEW
    PROPERTIES
    Molecular weight701.15
    AlogP6.51
    HBond donors5
    HBond acceptors12
    Atoms80
    Contains toxicophoreNo
    Contains PAINSNo
    Commercially availableUnknown
    Property color indications are based on Lipinski's Ro5.
    PROTEIN TARGETS
    No information about proteins targeted by canSAR706357.