canSAR2153778
FEATURES
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NAMES
    SMILES
    O=C(Nc1ccccn1)c1ccccc1Sc1ccc2c(/C=C/c3ccccn3)n[nH]c2c1
    InChI
    InChI=1S/C26H19N5OS/c32-26(29-25-10-4-6-16-28-25)21-8-1-2-9-24(21)33-19-12-13-20-22(30-31-23(20)17-19)14-11-18-7-3-5-15-27-18/h1-17H,(H,30,31)(H,28,29,32)/b14-11+
    MOLECULAR FORMULA
    C26H19N5OS
    CROSS REFERENCES
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    canSAR2153778
    Compound Synopsis
    OVERVIEW
    PROPERTIES
    Molecular weight449.13
    AlogP5.93
    HBond donors2
    HBond acceptors6
    Atoms52
    Contains toxicophoreNo
    Contains PAINSNo
    Commercially availableUnknown
    Property color indications are based on Lipinski's Ro5.
    PROTEIN TARGETS
    No information about proteins targeted by canSAR2153778.