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canSAR1017888
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NAMES
    SMILES
    Clc1ccc(C2=NN(c3ncc(Br)cn3)[C@@H](c3ccc(Cl)cc3)C2)cc1
    InChI
    InChI=1S/C19H13BrCl2N4/c20-14-10-23-19(24-11-14)26-18(13-3-7-16(22)8-4-13)9-17(25-26)12-1-5-15(21)6-2-12/h1-8,10-11,18H,9H2/t18-/m1/s1
    MOLECULAR FORMULA
    C19H13BrCl2N4
    CROSS REFERENCES
    1017888 logo

    canSAR1017888

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 445.97
    AlogP 5.90
    HBond donors 0
    HBond acceptors 4
    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 canSAR1017888.