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canSAR168898
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NAMES
    SMILES
    CCOc1cc(CN2CCC(Nc3nc4cc(S(N)(=O)=O)ccc4o3)CC2)ccc1Cl
    InChI
    InChI=1S/C21H25ClN4O4S/c1-2-29-20-11-14(3-5-17(20)22)13-26-9-7-15(8-10-26)24-21-25-18-12-16(31(23,27)28)4-6-19(18)30-21/h3-6,11-12,15H,2,7-10,13H2,1H3,(H,24,25)(H2,23,27,28)
    MOLECULAR FORMULA
    C21H25ClN4O4S
    CROSS REFERENCES
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    canSAR168898

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 464.13
    AlogP 3.60
    HBond donors 3
    HBond acceptors 8
    Atoms 56
    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 canSAR168898.