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canSAR989359
FEATURES
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NAMES
    SMILES
    C[C@H]1CN(C[C@@]2(O)CC[C@@]3(C)[C@@H](CC[C@H]4[C@@H]5CCC(=O)[C@@]5(C)CC[C@@H]43)C2)[C@H](C)CN1Cc1ccc(C(F)(F)F)cc1C(F)(F)F
    InChI
    InChI=1S/C35H48F6N2O2/c1-21-18-43(22(2)17-42(21)19-23-5-6-24(34(36,37)38)15-29(23)35(39,40)41)20-33(45)14-13-31(3)25(16-33)7-8-26-27-9-10-30(44)32(27,4)12-11-28(26)31/h5-6,15,21-22,25-28,45H,7-14,16-20H2,1-4H3/t21-,22+,25-,26-,27-,28-,31-,32-,33+/m0/s1
    MOLECULAR FORMULA
    C35H48F6N2O2
    CROSS REFERENCES
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    canSAR989359

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 642.36
    AlogP 7.96
    HBond donors 1
    HBond acceptors 4
    Atoms 93
    Contains toxicophore Yes
    Contains PAINS No
    Commercially available Unknown
    Property color indications are based on Lipinski's Ro5.
    PROTEIN TARGETS
    No information about proteins targeted by canSAR989359.