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canSAR34819
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NAMES
    SMILES
    COP(=O)(c1ccccc1)N1CCCC(c2ccc(Cl)c(C(F)(F)F)c2)=N1
    InChI
    InChI=1S/C18H17ClF3N2O2P/c1-26-27(25,14-6-3-2-4-7-14)24-11-5-8-17(23-24)13-9-10-16(19)15(12-13)18(20,21)22/h2-4,6-7,9-10,12H,5,8,11H2,1H3
    MOLECULAR FORMULA
    C18H17ClF3N2O2P
    CROSS REFERENCES
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    canSAR34819

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 416.07
    AlogP 5.32
    HBond donors 0
    HBond acceptors 4
    Atoms 44
    Contains toxicophore Yes
    Contains PAINS No
    Commercially available Unknown
    Property color indications are based on Lipinski's Ro5.
    PROTEIN TARGETS
    No information about proteins targeted by canSAR34819.