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canSAR1526269
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NAMES
    SMILES
    COc1cc(F)c(C(C)C)cc1-c1ccc(N(C)C)nc1[C@@H]1CC[C@H]2[C@@H](c3cc(C(F)(F)F)cc(C(F)(F)F)c3)OC(=O)N12
    InChI
    InChI=1S/C31H30F7N3O3/c1-15(2)20-13-21(25(43-5)14-22(20)32)19-6-9-26(40(3)4)39-27(19)23-7-8-24-28(44-29(42)41(23)24)16-10-17(30(33,34)35)12-18(11-16)31(36,37)38/h6,9-15,23-24,28H,7-8H2,1-5H3/t23-,24-,28+/m0/s1
    MOLECULAR FORMULA
    C31H30F7N3O3
    CROSS REFERENCES
    1526269 logo

    canSAR1526269

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 625.22
    AlogP 8.52
    HBond donors 0
    HBond acceptors 6
    Atoms 74
    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 canSAR1526269.