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canSAR1402825
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NAMES
    SMILES
    COc1ccc(/C(C)=N/NC(=S)NCCc2ccccc2)cc1
    InChI
    InChI=1S/C18H21N3OS/c1-14(16-8-10-17(22-2)11-9-16)20-21-18(23)19-13-12-15-6-4-3-5-7-15/h3-11H,12-13H2,1-2H3,(H2,19,21,23)/b20-14+
    MOLECULAR FORMULA
    C18H21N3OS
    CROSS REFERENCES
    1402825 logo

    canSAR1402825

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 327.14
    AlogP 3.13
    HBond donors 2
    HBond acceptors 4
    Atoms 44
    Contains toxicophore Yes
    Contains PAINS No
    Commercially available Unknown
    Property color indications are based on Lipinski's Ro5.
    PROTEIN TARGETS
    No information about proteins targeted by canSAR1402825.