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canSAR1156901
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NAMES
    SMILES
    C/C(=N\Nc1nc2c(C)cccc2s1)C(C)C
    InChI
    InChI=1S/C13H17N3S/c1-8(2)10(4)15-16-13-14-12-9(3)6-5-7-11(12)17-13/h5-8H,1-4H3,(H,14,16)/b15-10+
    MOLECULAR FORMULA
    C13H17N3S
    CROSS REFERENCES
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    canSAR1156901

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 247.11
    AlogP 4.05
    HBond donors 1
    HBond acceptors 3
    Atoms 34
    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 canSAR1156901.