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canSAR1688143
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NAMES
    SMILES
    Cc1ccc2nc(O)c(CN(Cc3cccs3)C(S)=NCc3ccco3)cc2c1
    InChI
    InChI=1S/C22H21N3O2S2/c1-15-6-7-20-16(10-15)11-17(21(26)24-20)13-25(14-19-5-3-9-29-19)22(28)23-12-18-4-2-8-27-18/h2-11H,12-14H2,1H3,(H,23,28)(H,24,26)
    MOLECULAR FORMULA
    C22H21N3O2S2
    CROSS REFERENCES
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    canSAR1688143

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 423.11
    AlogP 5.39
    HBond donors 1
    HBond acceptors 5
    Atoms 50
    Contains toxicophore Yes
    Contains PAINS No
    Commercially available Yes
    Property color indications are based on Lipinski's Ro5.
    PROTEIN TARGETS
    No information about proteins targeted by canSAR1688143.