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canSAR1972737
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NAMES
    SMILES
    Cc1ccccc1N1CC(C(=O)Nc2nnc(SCc3ccccn3)s2)CC1=O
    InChI
    InChI=1S/C20H19N5O2S2/c1-13-6-2-3-8-16(13)25-11-14(10-17(25)26)18(27)22-19-23-24-20(29-19)28-12-15-7-4-5-9-21-15/h2-9,14H,10-12H2,1H3,(H,22,23,27)
    MOLECULAR FORMULA
    C20H19N5O2S2
    CROSS REFERENCES
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    canSAR1972737

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 425.10
    AlogP 3.53
    HBond donors 1
    HBond acceptors 7
    Atoms 48
    Contains toxicophore No
    Contains PAINS No
    Commercially available Yes
    Property color indications are based on Lipinski's Ro5.
    PROTEIN TARGETS
    No information about proteins targeted by canSAR1972737.