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canSAR842742
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NAMES
    SMILES
    O=S1O[C@H](c2ccc(Cl)cc2)[C@@](Cn2cncn2)(c2ccc(Cl)cc2Cl)O1
    InChI
    InChI=1S/C17H12Cl3N3O3S/c18-12-3-1-11(2-4-12)16-17(26-27(24)25-16,8-23-10-21-9-22-23)14-6-5-13(19)7-15(14)20/h1-7,9-10,16H,8H2/t16-,17-,27?/m1/s1
    MOLECULAR FORMULA
    C17H12Cl3N3O3S
    CROSS REFERENCES
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    canSAR842742

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 442.97
    AlogP 4.50
    HBond donors 0
    HBond acceptors 6
    Atoms 39
    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 canSAR842742.