canSAR824463
FEATURES
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NAMES
    SMILES
    Cc1ccccc1CC(NC(=O)CCCC[C@]12CCC(C)(C)C[C@H]1C1=CC[C@@H]3[C@@]4(C)CC[C@H](O)C(C)(C)[C@@H]4CC[C@@]3(C)[C@]1(C)CC2)C(=O)O
    InChI
    InChI=1S/C44H67NO4/c1-29-13-9-10-14-30(29)27-33(38(48)49)45-37(47)15-11-12-20-44-25-23-39(2,3)28-32(44)31-16-17-35-41(6)21-19-36(46)40(4,5)34(41)18-22-43(35,8)42(31,7)24-26-44/h9-10,13-14,16,32-36,46H,11-12,15,17-28H2,1-8H3,(H,45,47)(H,48,49)/t32-,33?,34-,35+,36-,41-,42+,43+,44+/m0/s1
    MOLECULAR FORMULA
    C44H67NO4
    CROSS REFERENCES
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    canSAR824463
    Compound Synopsis
    OVERVIEW
    PROPERTIES
    Molecular weight673.51
    AlogP9.83
    HBond donors3
    HBond acceptors5
    Atoms116
    Contains toxicophoreNo
    Contains PAINSNo
    Commercially availableUnknown
    Property color indications are based on Lipinski's Ro5.
    PROTEIN TARGETS
    No information about proteins targeted by canSAR824463.