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canSAR643870
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NAMES
    SMILES
    CC(=O)O.Cc1c(CNc2ccc(Cl)c(Cl)c2Cl)cnc2nc(N)nc(N)c12
    InChI
    InChI=1S/C15H13Cl3N6.C2H4O2/c1-6-7(4-21-9-3-2-8(16)11(17)12(9)18)5-22-14-10(6)13(19)23-15(20)24-14;1-2(3)4/h2-3,5,21H,4H2,1H3,(H4,19,20,22,23,24);1H3,(H,3,4)
    MOLECULAR FORMULA
    C17H17Cl3N6O2
    CROSS REFERENCES
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    canSAR643870

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 442.05
    AlogP 4.16
    HBond donors 6
    HBond acceptors 8
    Atoms 45
    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 canSAR643870.