canSAR2095712
FEATURES
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NAMES
    SMILES
    Cc1c(C(=O)CSc2nc3ccccc3[nH]2)[n+]([O-])c2ccccc2[n+]1[O-]
    InChI
    InChI=1S/C18H14N4O3S/c1-11-17(22(25)15-9-5-4-8-14(15)21(11)24)16(23)10-26-18-19-12-6-2-3-7-13(12)20-18/h2-9H,10H2,1H3,(H,19,20)
    MOLECULAR FORMULA
    C18H14N4O3S
    CROSS REFERENCES
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    canSAR2095712
    Compound Synopsis
    OVERVIEW
    PROPERTIES
    Molecular weight366.08
    AlogP2.27
    HBond donors1
    HBond acceptors7
    Atoms40
    Contains toxicophoreNo
    Contains PAINSYes
    Commercially availableUnknown
    Property color indications are based on Lipinski's Ro5.
    PROTEIN TARGETS
    No information about proteins targeted by canSAR2095712.