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canSAR1618231
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NAMES
    SMILES
    Sc1nnc(Cc2ccc(Br)cc2)n1/N=C/c1ccc(Cl)cc1
    InChI
    InChI=1S/C16H12BrClN4S/c17-13-5-1-11(2-6-13)9-15-20-21-16(23)22(15)19-10-12-3-7-14(18)8-4-12/h1-8,10H,9H2,(H,21,23)/b19-10+
    MOLECULAR FORMULA
    C16H12BrClN4S
    CROSS REFERENCES
    1618231 logo

    canSAR1618231

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 405.97
    AlogP 4.46
    HBond donors 0
    HBond acceptors 4
    Atoms 35
    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 canSAR1618231.