canSAR1649466
FEATURES
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NAMES
    SMILES
    Cc1cc[n+](-c2[n-]c(=O)sc2C=NNC(=O)CCn2c3ccccc3c3ccccc32)cc1
    InChI
    InChI=1S/C25H21N5O2S/c1-17-10-13-29(14-11-17)24-22(33-25(32)27-24)16-26-28-23(31)12-15-30-20-8-4-2-6-18(20)19-7-3-5-9-21(19)30/h2-11,13-14,16H,12,15H2,1H3,(H-,26,27,28,31,32)
    MOLECULAR FORMULA
    C25H21N5O2S
    CROSS REFERENCES
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    canSAR1649466
    Compound Synopsis
    OVERVIEW
    PROPERTIES
    Molecular weight455.14
    AlogP3.30
    HBond donors1
    HBond acceptors7
    Atoms54
    Contains toxicophoreYes
    Contains PAINSNo
    Commercially availableYes
    Property color indications are based on Lipinski's Ro5.
    PROTEIN TARGETS
    No information about proteins targeted by canSAR1649466.