canSAR630451
FEATURES
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NAMES
    SMILES
    O=C(Nc1ccccc1)c1cc(S(=O)(=O)Nc2nc3cccnc3[nH]2)c(SSc2cc(Cl)c(C(=O)Nc3ccccc3)cc2S(=O)(=O)Nc2nc3cccnc3[nH]2)cc1Cl
    InChI
    InChI=1S/C38H26Cl2N10O6S4/c39-25-19-29(31(17-23(25)35(51)43-21-9-3-1-4-10-21)59(53,54)49-37-45-27-13-7-15-41-33(27)47-37)57-58-30-20-26(40)24(36(52)44-22-11-5-2-6-12-22)18-32(30)60(55,56)50-38-46-28-14-8-16-42-34(28)48-38/h1-20H,(H,43,51)(H,44,52)(H2,41,45,47,49)(H2,42,46,48,50)
    MOLECULAR FORMULA
    C38H26Cl2N10O6S4
    CROSS REFERENCES
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    canSAR630451
    Compound Synopsis
    OVERVIEW
    PROPERTIES
    Molecular weight916.03
    AlogP8.44
    HBond donors6
    HBond acceptors16
    Atoms86
    Contains toxicophoreYes
    Contains PAINSNo
    Commercially availableUnknown
    Property color indications are based on Lipinski's Ro5.
    PROTEIN TARGETS
    No information about proteins targeted by canSAR630451.