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canSAR1688294
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NAMES
    SMILES
    CNC(=O)n1cc(NC(=O)N2[C@H](C(=O)N[C@H](COC)c3cccc(Cl)c3F)C[C@H]3C[C@H]32)c2ccccc21
    InChI
    InChI=1S/C26H27ClFN5O4/c1-29-25(35)32-12-18(15-6-3-4-9-20(15)32)31-26(36)33-21-10-14(21)11-22(33)24(34)30-19(13-37-2)16-7-5-8-17(27)23(16)28/h3-9,12,14,19,21-22H,10-11,13H2,1-2H3,(H,29,35)(H,30,34)(H,31,36)/t14-,19-,21-,22+/m1/s1
    MOLECULAR FORMULA
    C26H27ClFN5O4
    CROSS REFERENCES
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    canSAR1688294

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 527.17
    AlogP 4.12
    HBond donors 3
    HBond acceptors 9
    Atoms 64
    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 canSAR1688294.