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canSAR1088731
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NAMES
    SMILES
    O=C(c1cc(Cc2n[nH]c(=O)c3ccccc23)ccc1F)N1CCc2cccc3c2C1CNC3
    InChI
    InChI=1S/C27H23FN4O2/c28-22-9-8-16(13-23-19-6-1-2-7-20(19)26(33)31-30-23)12-21(22)27(34)32-11-10-17-4-3-5-18-14-29-15-24(32)25(17)18/h1-9,12,24,29H,10-11,13-15H2,(H,31,33)
    MOLECULAR FORMULA
    C27H23FN4O2
    CROSS REFERENCES
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    canSAR1088731

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 454.18
    AlogP 3.50
    HBond donors 2
    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 canSAR1088731.