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canSAR1441318
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NAMES
    SMILES
    Cc1nn(C2CCCCC2)c2sc(C(=O)Nc3ccc(N4CCN(C)CC4)cc3)cc12
    InChI
    InChI=1S/C24H31N5OS/c1-17-21-16-22(31-24(21)29(26-17)20-6-4-3-5-7-20)23(30)25-18-8-10-19(11-9-18)28-14-12-27(2)13-15-28/h8-11,16,20H,3-7,12-15H2,1-2H3,(H,25,30)
    MOLECULAR FORMULA
    C24H31N5OS
    CROSS REFERENCES
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    canSAR1441318

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 437.22
    AlogP 4.92
    HBond donors 1
    HBond acceptors 6
    Atoms 62
    Contains toxicophore No
    Contains PAINS Yes
    Commercially available Unknown
    Property color indications are based on Lipinski's Ro5.
    PROTEIN TARGETS
    No information about proteins targeted by canSAR1441318.