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canSAR1027599
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NAMES
    SMILES
    OC[C@H]1O[C@H](n2c(Cl)nc3cc(Cl)c(Cl)cc32)[C@@H](O)[C@H]1O
    InChI
    InChI=1S/C12H11Cl3N2O4/c13-4-1-6-7(2-5(4)14)17(12(15)16-6)11-10(20)9(19)8(3-18)21-11/h1-2,8-11,18-20H,3H2/t8-,9+,10+,11+/m1/s1
    MOLECULAR FORMULA
    C12H11Cl3N2O4
    CROSS REFERENCES
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    canSAR1027599

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 351.98
    AlogP 1.61
    HBond donors 3
    HBond acceptors 6
    Atoms 32
    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 canSAR1027599.