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canSAR1088822
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NAMES
    SMILES
    NC1CC2c3c(cccc31)CCN2C(=O)c1cc(Cc2n[nH]c(=O)c3ccccc23)ccc1F
    InChI
    InChI=1S/C27H23FN4O2/c28-21-9-8-15(13-23-17-5-1-2-6-18(17)26(33)31-30-23)12-20(21)27(34)32-11-10-16-4-3-7-19-22(29)14-24(32)25(16)19/h1-9,12,22,24H,10-11,13-14,29H2,(H,31,33)
    MOLECULAR FORMULA
    C27H23FN4O2
    CROSS REFERENCES
    1088822 logo

    canSAR1088822

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 454.18
    AlogP 3.80
    HBond donors 3
    HBond acceptors 6
    Atoms 57
    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 canSAR1088822.