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canSAR499653
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NAMES
    SMILES
    CCOc1cccc2c1c(/C=C1\C(=O)NN=C1c1snnc1C)cn2C
    InChI
    InChI=1S/C18H17N5O2S/c1-4-25-14-7-5-6-13-15(14)11(9-23(13)3)8-12-16(20-21-18(12)24)17-10(2)19-22-26-17/h5-9H,4H2,1-3H3,(H,21,24)/b12-8-
    MOLECULAR FORMULA
    C18H17N5O2S
    CROSS REFERENCES
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    canSAR499653

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 367.11
    AlogP 2.65
    HBond donors 1
    HBond acceptors 7
    Atoms 43
    Contains toxicophore No
    Contains PAINS Yes
    Commercially available Unknown
    Property color indications are based on Lipinski's Ro5.
    PROTEIN TARGETS
    No information about proteins targeted by canSAR499653.