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canSAR1062888
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NAMES
    SMILES
    CCc1cnc(N2CCC(C3Cc4cc(C5CCN(S(C)(=O)=O)CC5)ncc4O3)CC2)nc1
    InChI
    InChI=1S/C24H33N5O3S/c1-3-17-14-26-24(27-15-17)28-8-4-19(5-9-28)22-13-20-12-21(25-16-23(20)32-22)18-6-10-29(11-7-18)33(2,30)31/h12,14-16,18-19,22H,3-11,13H2,1-2H3
    MOLECULAR FORMULA
    C24H33N5O3S
    CROSS REFERENCES
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    canSAR1062888

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 471.23
    AlogP 2.79
    HBond donors 0
    HBond acceptors 8
    Atoms 66
    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 canSAR1062888.