canSAR735996
FEATURES
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NAMES
    SMILES
    Nc1nc(N)c2c(OCC3CCN(S(=O)(=O)c4cccc5ccccc45)CC3)cccc2n1
    InChI
    InChI=1S/C24H25N5O3S/c25-23-22-19(27-24(26)28-23)8-4-9-20(22)32-15-16-11-13-29(14-12-16)33(30,31)21-10-3-6-17-5-1-2-7-18(17)21/h1-10,16H,11-15H2,(H4,25,26,27,28)
    MOLECULAR FORMULA
    C24H25N5O3S
    CROSS REFERENCES
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    canSAR735996
    Compound Synopsis
    OVERVIEW
    PROPERTIES
    Molecular weight463.17
    AlogP3.43
    HBond donors4
    HBond acceptors8
    Atoms58
    Contains toxicophoreNo
    Contains PAINSNo
    Commercially availableUnknown
    Property color indications are based on Lipinski's Ro5.
    PROTEIN TARGETS
    No information about proteins targeted by canSAR735996.