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canSAR1524968
FEATURES
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NAMES
    SMILES
    CCOc1nc(C(=O)NCc2ccc(S(N)(=O)=O)cc2)cc(N)c1C#N
    InChI
    InChI=1S/C16H17N5O4S/c1-2-25-16-12(8-17)13(18)7-14(21-16)15(22)20-9-10-3-5-11(6-4-10)26(19,23)24/h3-7H,2,9H2,1H3,(H2,18,21)(H,20,22)(H2,19,23,24)
    MOLECULAR FORMULA
    C16H17N5O4S
    CROSS REFERENCES
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    canSAR1524968

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 375.10
    AlogP 0.51
    HBond donors 5
    HBond acceptors 9
    Atoms 43
    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 canSAR1524968.