canSAR63727
FEATURES
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NAMES
    SMILES
    Cc1cc(C)c(S(=O)(=O)N[C@@H](Cc2ccc(-c3cccc(NC(=O)Nc4nc5ccccc5[nH]4)c3)cc2)C(=O)O)c(C)c1
    InChI
    InChI=1S/C32H31N5O5S/c1-19-15-20(2)29(21(3)16-19)43(41,42)37-28(30(38)39)17-22-11-13-23(14-12-22)24-7-6-8-25(18-24)33-32(40)36-31-34-26-9-4-5-10-27(26)35-31/h4-16,18,28,37H,17H2,1-3H3,(H,38,39)(H3,33,34,35,36,40)/t28-/m0/s1
    MOLECULAR FORMULA
    C32H31N5O5S
    CROSS REFERENCES
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    canSAR63727
    Compound Synopsis
    OVERVIEW
    PROPERTIES
    Molecular weight597.20
    AlogP5.77
    HBond donors5
    HBond acceptors10
    Atoms74
    Contains toxicophoreNo
    Contains PAINSNo
    Commercially availableUnknown
    Property color indications are based on Lipinski's Ro5.
    PROTEIN TARGETS
    No information about proteins targeted by canSAR63727.