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canSAR829353
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NAMES
    SMILES
    O=C(NCc1ccccc1)c1c(-c2ccccc2)[n+]([O-])c2ccc(F)cc2[n+]1[O-]
    InChI
    InChI=1S/C22H16FN3O3/c23-17-11-12-18-19(13-17)26(29)21(20(25(18)28)16-9-5-2-6-10-16)22(27)24-14-15-7-3-1-4-8-15/h1-13H,14H2,(H,24,27)
    MOLECULAR FORMULA
    C22H16FN3O3
    CROSS REFERENCES
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    canSAR829353

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 389.12
    AlogP 2.84
    HBond donors 1
    HBond acceptors 6
    Atoms 45
    Contains toxicophore No
    Contains PAINS Yes
    Commercially available Unknown
    Property color indications are based on Lipinski's Ro5.
    PROTEIN TARGETS
    No information about proteins targeted by canSAR829353.