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canSAR1619964
FEATURES
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NAMES
    SMILES
    O=C(CN1C(=O)COc2ccc(S(=O)(=O)N3CCOCC3)cc21)NCc1ccccn1
    InChI
    InChI=1S/C20H22N4O6S/c25-19(22-12-15-3-1-2-6-21-15)13-24-17-11-16(4-5-18(17)30-14-20(24)26)31(27,28)23-7-9-29-10-8-23/h1-6,11H,7-10,12-14H2,(H,22,25)
    MOLECULAR FORMULA
    C20H22N4O6S
    CROSS REFERENCES
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    canSAR1619964

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 446.13
    AlogP 0.14
    HBond donors 1
    HBond acceptors 10
    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 canSAR1619964.