canSAR2255188
FEATURES
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NAMES
    SMILES
    O=C(NCc1cccnc1)c1cnc2c(SSc3cccc4cc(C(=O)NCc5cccnc5)cnc34)cccc2c1
    InChI
    InChI=1S/C32H24N6O2S2/c39-31(37-17-21-5-3-11-33-15-21)25-13-23-7-1-9-27(29(23)35-19-25)41-42-28-10-2-8-24-14-26(20-36-30(24)28)32(40)38-18-22-6-4-12-34-16-22/h1-16,19-20H,17-18H2,(H,37,39)(H,38,40)
    MOLECULAR FORMULA
    C32H24N6O2S2
    CROSS REFERENCES
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    canSAR2255188
    Compound Synopsis
    OVERVIEW
    PROPERTIES
    Molecular weight588.14
    AlogP6.23
    HBond donors2
    HBond acceptors8
    Atoms66
    Contains toxicophoreYes
    Contains PAINSNo
    Commercially availableUnknown
    Property color indications are based on Lipinski's Ro5.
    PROTEIN TARGETS
    No information about proteins targeted by canSAR2255188.