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canSAR1528718
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NAMES
    SMILES
    [C-]#[N+]c1ccc(-c2cnnc3c2ncn3CC)cc1-c1ccc(S(=O)(=O)CC)cc1OC
    InChI
    InChI=1S/C23H21N5O3S/c1-5-28-14-25-22-19(13-26-27-23(22)28)15-7-10-20(24-3)18(11-15)17-9-8-16(12-21(17)31-4)32(29,30)6-2/h7-14H,5-6H2,1-2,4H3
    MOLECULAR FORMULA
    C23H21N5O3S
    CROSS REFERENCES
    1528718 logo

    canSAR1528718

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 447.14
    AlogP 4.53
    HBond donors 0
    HBond acceptors 8
    Atoms 53
    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 canSAR1528718.