canSAR824536
FEATURES
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NAMES
    SMILES
    C=C1/C(=C\C=C2/CCC[C@@]3(C)C2CC[C@@H]3[C@H](C)C[C@H]2C[C@@](C)(O)C(=O)N2CCCCc2ccccc2)C[C@@H](O)C[C@@H]1O
    InChI
    InChI=1S/C37H53NO4/c1-25(21-30-24-37(4,42)35(41)38(30)20-9-8-13-27-11-6-5-7-12-27)32-17-18-33-28(14-10-19-36(32,33)3)15-16-29-22-31(39)23-34(40)26(29)2/h5-7,11-12,15-16,25,30-34,39-40,42H,2,8-10,13-14,17-24H2,1,3-4H3/b28-15+,29-16-/t25-,30+,31-,32-,33?,34+,36-,37-/m1/s1
    MOLECULAR FORMULA
    C37H53NO4
    CROSS REFERENCES
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    canSAR824536
    Compound Synopsis
    OVERVIEW
    PROPERTIES
    Molecular weight575.40
    AlogP6.53
    HBond donors3
    HBond acceptors5
    Atoms95
    Contains toxicophoreYes
    Contains PAINSNo
    Commercially availableUnknown
    Property color indications are based on Lipinski's Ro5.
    PROTEIN TARGETS
    No information about proteins targeted by canSAR824536.