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canSAR1828366
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NAMES
    SMILES
    O=C(Nc1ccnn1C1CCN(C(=O)c2ccc(Cl)c(F)c2)CC1)C1CCOC1
    InChI
    InChI=1S/C20H22ClFN4O3/c21-16-2-1-13(11-17(16)22)20(28)25-8-4-15(5-9-25)26-18(3-7-23-26)24-19(27)14-6-10-29-12-14/h1-3,7,11,14-15H,4-6,8-10,12H2,(H,24,27)
    MOLECULAR FORMULA
    C20H22ClFN4O3
    CROSS REFERENCES
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    canSAR1828366

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 420.14
    AlogP 3.13
    HBond donors 1
    HBond acceptors 7
    Atoms 51
    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 canSAR1828366.