canSAR1031109
FEATURES
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NAMES
    SMILES
    C=CCc1cc(NC(=O)C2CCCCC2)ccc1OC/C=C(\C)CC/C=C(\C)CCC=C(C)C
    InChI
    InChI=1S/C31H45NO2/c1-6-12-28-23-29(32-31(33)27-17-8-7-9-18-27)19-20-30(28)34-22-21-26(5)16-11-15-25(4)14-10-13-24(2)3/h6,13,15,19-21,23,27H,1,7-12,14,16-18,22H2,2-5H3,(H,32,33)/b25-15+,26-21+
    MOLECULAR FORMULA
    C31H45NO2
    CROSS REFERENCES
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    canSAR1031109
    Compound Synopsis
    OVERVIEW
    PROPERTIES
    Molecular weight463.35
    AlogP8.73
    HBond donors1
    HBond acceptors3
    Atoms79
    Contains toxicophoreNo
    Contains PAINSNo
    Commercially availableUnknown
    Property color indications are based on Lipinski's Ro5.
    PROTEIN TARGETS
    No information about proteins targeted by canSAR1031109.