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canSAR1638726
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NAMES
    SMILES
    COCC(=O)N(Cc1nc(O)c2ccccc2n1)Cc1cccs1
    InChI
    InChI=1S/C17H17N3O3S/c1-23-11-16(21)20(9-12-5-4-8-24-12)10-15-18-14-7-3-2-6-13(14)17(22)19-15/h2-8H,9-11H2,1H3,(H,18,19,22)
    MOLECULAR FORMULA
    C17H17N3O3S
    CROSS REFERENCES
    1638726 logo

    canSAR1638726

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 343.10
    AlogP 2.57
    HBond donors 1
    HBond acceptors 6
    Atoms 41
    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 canSAR1638726.