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canSAR2021671
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NAMES
    SMILES
    CCNc1nc(-c2ccc(S(=O)(=O)CCN3CCCC3)cc2)cc2ncn(C)c(=O)c12
    InChI
    InChI=1S/C22H27N5O3S/c1-3-23-21-20-19(24-15-26(2)22(20)28)14-18(25-21)16-6-8-17(9-7-16)31(29,30)13-12-27-10-4-5-11-27/h6-9,14-15H,3-5,10-13H2,1-2H3,(H,23,25)
    MOLECULAR FORMULA
    C22H27N5O3S
    CROSS REFERENCES
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    canSAR2021671

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 441.18
    AlogP 2.30
    HBond donors 1
    HBond acceptors 8
    Atoms 58
    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 canSAR2021671.