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canSAR20862
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NAMES
    SMILES
    COc1ccc(Cl)c2c1NC(=O)C2N/N=C(\S)Nc1cc(Cl)cc(Cl)c1
    InChI
    InChI=1S/C16H13Cl3N4O2S/c1-25-11-3-2-10(19)12-13(11)21-15(24)14(12)22-23-16(26)20-9-5-7(17)4-8(18)6-9/h2-6,14,22H,1H3,(H,21,24)(H2,20,23,26)
    MOLECULAR FORMULA
    C16H13Cl3N4O2S
    CROSS REFERENCES
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    canSAR20862

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 429.98
    AlogP 4.55
    HBond donors 3
    HBond acceptors 6
    Atoms 39
    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 canSAR20862.