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canSAR784608
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NAMES
    SMILES
    O=C1O[C@H](c2ccc(Cl)cc2)[C@@](Cn2cncn2)(c2ccc(Cl)cc2Cl)O1
    InChI
    InChI=1S/C18H12Cl3N3O3/c19-12-3-1-11(2-4-12)16-18(27-17(25)26-16,8-24-10-22-9-23-24)14-6-5-13(20)7-15(14)21/h1-7,9-10,16H,8H2/t16-,18-/m1/s1
    MOLECULAR FORMULA
    C18H12Cl3N3O3
    CROSS REFERENCES
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    canSAR784608

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 422.99
    AlogP 5.04
    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 canSAR784608.