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canSAR1490691
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NAMES
    SMILES
    COC1CCN(Cc2cccc(-n3nc(C(=O)N4CCOCC4)c4c3-c3ccccc3S(=O)(=O)C4)c2)CC1
    InChI
    InChI=1S/C28H32N4O5S/c1-36-22-9-11-30(12-10-22)18-20-5-4-6-21(17-20)32-27-23-7-2-3-8-25(23)38(34,35)19-24(27)26(29-32)28(33)31-13-15-37-16-14-31/h2-8,17,22H,9-16,18-19H2,1H3
    MOLECULAR FORMULA
    C28H32N4O5S
    CROSS REFERENCES
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    canSAR1490691

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 536.21
    AlogP 2.91
    HBond donors 0
    HBond acceptors 9
    Atoms 70
    Contains toxicophore No
    Contains PAINS No
    Commercially available Unknown
    Property color indications are based on Lipinski's Ro5.
    PROTEIN TARGETS
    No information about proteins targeted by canSAR1490691.