canSAR1648841
FEATURES
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NAMES
    SMILES
    O=[N+]([O-])c1cc(-c2csc(NC(CO)c3nc4ccccc4n3CCOCCO)n2)ccc1Cl
    InChI
    InChI=1S/C22H22ClN5O5S/c23-15-6-5-14(11-20(15)28(31)32)18-13-34-22(26-18)25-17(12-30)21-24-16-3-1-2-4-19(16)27(21)7-9-33-10-8-29/h1-6,11,13,17,29-30H,7-10,12H2,(H,25,26)
    MOLECULAR FORMULA
    C22H22ClN5O5S
    CROSS REFERENCES
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    canSAR1648841
    Compound Synopsis
    OVERVIEW
    PROPERTIES
    Molecular weight503.10
    AlogP3.88
    HBond donors3
    HBond acceptors10
    Atoms56
    Contains toxicophoreYes
    Contains PAINSNo
    Commercially availableUnknown
    Property color indications are based on Lipinski's Ro5.
    PROTEIN TARGETS
    No information about proteins targeted by canSAR1648841.