canSAR1651276
FEATURES
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NAMES
    SMILES
    COc1ccc(Cc2c(O)nc(SCC(=O)NC34CC5CC(CC(C5)C3)C4)nc2O)cc1
    InChI
    InChI=1S/C24H29N3O4S/c1-31-18-4-2-14(3-5-18)9-19-21(29)25-23(26-22(19)30)32-13-20(28)27-24-10-15-6-16(11-24)8-17(7-15)12-24/h2-5,15-17H,6-13H2,1H3,(H,27,28)(H2,25,26,29,30)
    MOLECULAR FORMULA
    C24H29N3O4S
    CROSS REFERENCES
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    canSAR1651276
    Compound Synopsis
    OVERVIEW
    PROPERTIES
    Molecular weight455.19
    AlogP3.66
    HBond donors3
    HBond acceptors7
    Atoms61
    Contains toxicophoreYes
    Contains PAINSNo
    Commercially availableYes
    Property color indications are based on Lipinski's Ro5.
    PROTEIN TARGETS
    No information about proteins targeted by canSAR1651276.