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canSAR2017705
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NAMES
    SMILES
    NC(=O)CSc1nnc(C2CC2)n1-c1ccccc1
    InChI
    InChI=1S/C13H14N4OS/c14-11(18)8-19-13-16-15-12(9-6-7-9)17(13)10-4-2-1-3-5-10/h1-5,9H,6-8H2,(H2,14,18)
    MOLECULAR FORMULA
    C13H14N4OS
    CROSS REFERENCES
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    canSAR2017705

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 274.09
    AlogP 1.72
    HBond donors 2
    HBond acceptors 5
    Atoms 33
    Contains toxicophore No
    Contains PAINS No
    Commercially available Yes
    Property color indications are based on Lipinski's Ro5.
    PROTEIN TARGETS
    No information about proteins targeted by canSAR2017705.