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canSAR990543
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)CN1Cc1cccc(C(F)(F)F)c1
    InChI
    InChI=1S/C34H49F3N2O2/c1-22-19-39(23(2)18-38(22)20-24-6-5-7-25(16-24)34(35,36)37)21-33(41)15-14-31(3)26(17-33)8-9-27-28-10-11-30(40)32(28,4)13-12-29(27)31/h5-7,16,22-23,26-29,41H,8-15,17-21H2,1-4H3/t22-,23+,26-,27-,28-,29-,31-,32-,33+/m0/s1
    MOLECULAR FORMULA
    C34H49F3N2O2
    CROSS REFERENCES
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    canSAR990543

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 574.37
    AlogP 6.94
    HBond donors 1
    HBond acceptors 4
    Atoms 90
    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 canSAR990543.