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canSAR1766486
FEATURES
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NAMES
    SMILES
    O=C(CCc1ccc(S(=O)(=O)N2CCOCC2)cc1)NCCc1ccccn1
    InChI
    InChI=1S/C20H25N3O4S/c24-20(22-12-10-18-3-1-2-11-21-18)9-6-17-4-7-19(8-5-17)28(25,26)23-13-15-27-16-14-23/h1-5,7-8,11H,6,9-10,12-16H2,(H,22,24)
    MOLECULAR FORMULA
    C20H25N3O4S
    CROSS REFERENCES
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    canSAR1766486

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 403.16
    AlogP 1.39
    HBond donors 1
    HBond acceptors 7
    Atoms 53
    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 canSAR1766486.