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canSAR1687331
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NAMES
    SMILES
    O=C(Nc1cc[nH]c(=O)c1)c1cc(C(F)(F)F)ccc1OCCC(F)(F)F
    InChI
    InChI=1S/C16H12F6N2O3/c17-15(18,19)4-6-27-12-2-1-9(16(20,21)22)7-11(12)14(26)24-10-3-5-23-13(25)8-10/h1-3,5,7-8H,4,6H2,(H2,23,24,25,26)
    MOLECULAR FORMULA
    C16H12F6N2O3
    CROSS REFERENCES
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    canSAR1687331

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 394.08
    AlogP 3.98
    HBond donors 2
    HBond acceptors 5
    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 canSAR1687331.