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canSAR789141
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NAMES
    SMILES
    COc1ccc([C@@H]2CN(c3nc4c(cc3F)c(=O)c(C(=O)O)cn4C3CC3)C[C@@H]2N)cc1
    InChI
    InChI=1S/C23H23FN4O4/c1-32-14-6-2-12(3-7-14)16-9-27(11-19(16)25)22-18(24)8-15-20(29)17(23(30)31)10-28(13-4-5-13)21(15)26-22/h2-3,6-8,10,13,16,19H,4-5,9,11,25H2,1H3,(H,30,31)/t16-,19-/m0/s1
    MOLECULAR FORMULA
    C23H23FN4O4
    CROSS REFERENCES
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    canSAR789141

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 438.17
    AlogP 2.51
    HBond donors 3
    HBond acceptors 8
    Atoms 55
    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 canSAR789141.