canSAR1775078
FEATURES
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NAMES
    SMILES
    CN(C(=O)c1cncs1)C1CCCN(c2nc(Cl)nc3cc(N4CCOCC4)ccc23)C1
    InChI
    InChI=1S/C22H25ClN6O2S/c1-27(21(30)19-12-24-14-32-19)16-3-2-6-29(13-16)20-17-5-4-15(28-7-9-31-10-8-28)11-18(17)25-22(23)26-20/h4-5,11-12,14,16H,2-3,6-10,13H2,1H3
    MOLECULAR FORMULA
    C22H25ClN6O2S
    CROSS REFERENCES
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    canSAR1775078
    Compound Synopsis
    OVERVIEW
    PROPERTIES
    Molecular weight472.14
    AlogP3.32
    HBond donors0
    HBond acceptors8
    Atoms57
    Contains toxicophoreNo
    Contains PAINSNo
    Commercially availableUnknown
    Property color indications are based on Lipinski's Ro5.
    PROTEIN TARGETS
    No information about proteins targeted by canSAR1775078.