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canSAR1126328
FEATURES
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NAMES
    SMILES
    Cc1cn(C[C@H]2CN(c3ccc(N4CCN(C(=O)CNC(=O)c5ccccc5)CC4)c(F)c3)C(=O)O2)nn1
    InChI
    InChI=1S/C26H28FN7O4/c1-18-15-33(30-29-18)16-21-17-34(26(37)38-21)20-7-8-23(22(27)13-20)31-9-11-32(12-10-31)24(35)14-28-25(36)19-5-3-2-4-6-19/h2-8,13,15,21H,9-12,14,16-17H2,1H3,(H,28,36)/t21-/m0/s1
    MOLECULAR FORMULA
    C26H28FN7O4
    CROSS REFERENCES
    1126328 logo

    canSAR1126328

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 521.22
    AlogP 1.83
    HBond donors 1
    HBond acceptors 11
    Atoms 66
    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 canSAR1126328.