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canSAR782967
FEATURES
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NAMES
    SMILES
    C[C@H]1OC(=O)[C@@H]2C[C@@H]3CN(C(=O)C4CC4)CC[C@H]3[C@H](/C=C/c3ccc(-c4cccc(C(F)(F)F)c4)cn3)[C@H]12
    InChI
    InChI=1S/C30H31F3N2O3/c1-17-27-25(10-9-23-8-7-20(15-34-23)19-3-2-4-22(13-19)30(31,32)33)24-11-12-35(28(36)18-5-6-18)16-21(24)14-26(27)29(37)38-17/h2-4,7-10,13,15,17-18,21,24-27H,5-6,11-12,14,16H2,1H3/b10-9+/t17-,21-,24-,25+,26-,27+/m1/s1
    MOLECULAR FORMULA
    C30H31F3N2O3
    CROSS REFERENCES
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    canSAR782967

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 524.23
    AlogP 5.85
    HBond donors 0
    HBond acceptors 5
    Atoms 69
    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 canSAR782967.