canSAR614141
FEATURES
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NAMES
    SMILES
    Cc1cc(C)nc(NS(=O)(=O)c2ccc(Nc3c4ccc(Cl)cc4nc4c(C(=O)Nc5ccc(S(=O)(=O)N=C(N)N)cc5)cccc34)cc2)n1
    InChI
    InChI=1S/C33H28ClN9O5S2/c1-18-16-19(2)38-33(37-18)43-50(47,48)24-11-7-21(8-12-24)39-29-25-15-6-20(34)17-28(25)41-30-26(29)4-3-5-27(30)31(44)40-22-9-13-23(14-10-22)49(45,46)42-32(35)36/h3-17H,1-2H3,(H,39,41)(H,40,44)(H4,35,36,42)(H,37,38,43)
    MOLECULAR FORMULA
    C33H28ClN9O5S2
    CROSS REFERENCES
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    canSAR614141
    Compound Synopsis
    OVERVIEW
    PROPERTIES
    Molecular weight729.13
    AlogP5.21
    HBond donors7
    HBond acceptors14
    Atoms78
    Contains toxicophoreNo
    Contains PAINSYes
    Commercially availableUnknown
    Property color indications are based on Lipinski's Ro5.
    PROTEIN TARGETS
    No information about proteins targeted by canSAR614141.