canSAR2095865
FEATURES
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NAMES
    SMILES
    C[C@]12CC[C@H](O)[C@@](C)(C(=O)O)[C@@H]1C[C@H](O)c1cc3[nH]c4ccccc4c3cc12
    InChI
    InChI=1S/C23H25NO4/c1-22-8-7-20(26)23(2,21(27)28)19(22)11-18(25)14-10-17-13(9-15(14)22)12-5-3-4-6-16(12)24-17/h3-6,9-10,18-20,24-26H,7-8,11H2,1-2H3,(H,27,28)/t18-,19+,20-,22+,23-/m0/s1
    MOLECULAR FORMULA
    C23H25NO4
    CROSS REFERENCES
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    canSAR2095865
    Compound Synopsis
    OVERVIEW
    PROPERTIES
    Molecular weight379.18
    AlogP3.88
    HBond donors4
    HBond acceptors5
    Atoms53
    Contains toxicophoreNo
    Contains PAINSNo
    Commercially availableUnknown
    Property color indications are based on Lipinski's Ro5.
    PROTEIN TARGETS
    No information about proteins targeted by canSAR2095865.