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canSAR468131
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NAMES
    SMILES
    Nc1cc(Cl)nc(SC/C=C/c2ccccc2)n1
    InChI
    InChI=1S/C13H12ClN3S/c14-11-9-12(15)17-13(16-11)18-8-4-7-10-5-2-1-3-6-10/h1-7,9H,8H2,(H2,15,16,17)/b7-4+
    MOLECULAR FORMULA
    C13H12ClN3S
    CROSS REFERENCES
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    canSAR468131

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 277.04
    AlogP 3.52
    HBond donors 2
    HBond acceptors 3
    Atoms 30
    Contains toxicophore No
    Contains PAINS No
    Commercially available Unknown
    Property color indications are based on Lipinski's Ro5.
    PROTEIN TARGETS
    No information about proteins targeted by canSAR468131.