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canSAR1013786
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NAMES
    SMILES
    O=C1NC(=S)N/C1=C\c1cc2ccccc2[nH]1
    InChI
    InChI=1S/C12H9N3OS/c16-11-10(14-12(17)15-11)6-8-5-7-3-1-2-4-9(7)13-8/h1-6,13H,(H2,14,15,16,17)/b10-6-
    MOLECULAR FORMULA
    C12H9N3OS
    CROSS REFERENCES
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    canSAR1013786

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 243.05
    AlogP 1.51
    HBond donors 3
    HBond acceptors 4
    Atoms 26
    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 canSAR1013786.