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canSAR1685017
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NAMES
    SMILES
    COC(=O)Cn1c(C(=O)N(C)C)cc2c1C[C@H]1CN(C(=O)c3ccccc3)[C@@](Cc3ccc(F)cc3)(C(=O)OC)[C@@H]21
    InChI
    InChI=1S/C31H32FN3O6/c1-33(2)29(38)25-15-23-24(34(25)18-26(36)40-3)14-21-17-35(28(37)20-8-6-5-7-9-20)31(27(21)23,30(39)41-4)16-19-10-12-22(32)13-11-19/h5-13,15,21,27H,14,16-18H2,1-4H3/t21-,27+,31+/m0/s1
    MOLECULAR FORMULA
    C31H32FN3O6
    CROSS REFERENCES
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    canSAR1685017

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 561.23
    AlogP 3.07
    HBond donors 0
    HBond acceptors 9
    Atoms 73
    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 canSAR1685017.