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canSAR1618988
FEATURES
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NAMES
    SMILES
    COc1ccc(N2CCN(CCCNS(=O)(=O)c3ccc4c(c3)oc(=O)n4C)CC2)cc1
    InChI
    InChI=1S/C22H28N4O5S/c1-24-20-9-8-19(16-21(20)31-22(24)27)32(28,29)23-10-3-11-25-12-14-26(15-13-25)17-4-6-18(30-2)7-5-17/h4-9,16,23H,3,10-15H2,1-2H3
    MOLECULAR FORMULA
    C22H28N4O5S
    CROSS REFERENCES
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    canSAR1618988

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 460.18
    AlogP 1.63
    HBond donors 1
    HBond acceptors 9
    Atoms 60
    Contains toxicophore No
    Contains PAINS Yes
    Commercially available Yes
    Property color indications are based on Lipinski's Ro5.
    PROTEIN TARGETS
    No information about proteins targeted by canSAR1618988.