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canSAR1650730
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NAMES
    SMILES
    CCn1nc(C)c(NC(=O)c2cc(Br)ccc2Cl)c1C
    InChI
    InChI=1S/C14H15BrClN3O/c1-4-19-9(3)13(8(2)18-19)17-14(20)11-7-10(15)5-6-12(11)16/h5-7H,4H2,1-3H3,(H,17,20)
    MOLECULAR FORMULA
    C14H15BrClN3O
    CROSS REFERENCES
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    canSAR1650730

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 355.01
    AlogP 4.19
    HBond donors 1
    HBond acceptors 4
    Atoms 35
    Contains toxicophore No
    Contains PAINS No
    Commercially available Yes
    Property color indications are based on Lipinski's Ro5.
    PROTEIN TARGETS
    No information about proteins targeted by canSAR1650730.