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canSAR1431298
FEATURES
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NAMES
    SMILES
    CN(CCOc1ccc(CC2SC(=O)NC2=O)cc1)c1ccccn1.Cl
    InChI
    InChI=1S/C18H19N3O3S.ClH/c1-21(16-4-2-3-9-19-16)10-11-24-14-7-5-13(6-8-14)12-15-17(22)20-18(23)25-15;/h2-9,15H,10-12H2,1H3,(H,20,22,23);1H
    MOLECULAR FORMULA
    C18H20ClN3O3S
    CROSS REFERENCES
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    canSAR1431298

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 393.09
    AlogP 2.91
    HBond donors 1
    HBond acceptors 6
    Atoms 46
    Contains toxicophore No
    Contains PAINS No
    Commercially available Yes
    Property color indications are based on Lipinski's Ro5.
    PROTEIN TARGETS
    No information about proteins targeted by canSAR1431298.