canSAR824243
FEATURES
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NAMES
    SMILES
    C[C@H](CCC(=O)OCc1ccc(S(N)(=O)=O)cc1)[C@H]1CC[C@H]2C3[C@H](CC[C@@]21C)[C@@]1(C)CC[C@@H](O)C[C@H]1C[C@H]3O
    InChI
    InChI=1S/C31H47NO6S/c1-19(4-11-28(35)38-18-20-5-7-23(8-6-20)39(32,36)37)24-9-10-25-29-26(13-15-31(24,25)3)30(2)14-12-22(33)16-21(30)17-27(29)34/h5-8,19,21-22,24-27,29,33-34H,4,9-18H2,1-3H3,(H2,32,36,37)/t19-,21+,22-,24-,25+,26+,27-,29?,30+,31-/m1/s1
    MOLECULAR FORMULA
    C31H47NO6S
    CROSS REFERENCES
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    canSAR824243
    Compound Synopsis
    OVERVIEW
    PROPERTIES
    Molecular weight561.31
    AlogP4.78
    HBond donors4
    HBond acceptors7
    Atoms86
    Contains toxicophoreYes
    Contains PAINSNo
    Commercially availableUnknown
    Property color indications are based on Lipinski's Ro5.
    PROTEIN TARGETS
    No information about proteins targeted by canSAR824243.