canSAR1086274
FEATURES
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NAMES
    SMILES
    COC(=O)[C@@]1(C)CC[C@]2(C)CC[C@]3(C)C(=CC=C4[C@@]3(C)CC[C@H]3C(C)(C)C(=O)C(C#N)=C[C@]43C)[C@@H]2C1
    InChI
    InChI=1S/C32H43NO3/c1-27(2)23-11-12-32(7)24(30(23,5)17-20(19-33)25(27)34)10-9-21-22-18-29(4,26(35)36-8)14-13-28(22,3)15-16-31(21,32)6/h9-10,17,22-23H,11-16,18H2,1-8H3/t22-,23-,28+,29-,30-,31+,32+/m0/s1
    MOLECULAR FORMULA
    C32H43NO3
    CROSS REFERENCES
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    canSAR1086274
    Compound Synopsis
    OVERVIEW
    PROPERTIES
    Molecular weight489.32
    AlogP7.12
    HBond donors0
    HBond acceptors4
    Atoms79
    Contains toxicophoreNo
    Contains PAINSNo
    Commercially availableUnknown
    Property color indications are based on Lipinski's Ro5.
    PROTEIN TARGETS
    No information about proteins targeted by canSAR1086274.