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canSAR835578
FEATURES
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NAMES
    SMILES
    COc1cc([C@@H]2c3cc4c(cc3[C@@H](Nc3cc5c6ccccc6ccc5c5ccccc35)[C@H]3COC(=O)[C@@H]32)OCO4)cc(OC)c1O
    InChI
    InChI=1S/C39H31NO7/c1-43-33-13-21(14-34(44-2)38(33)41)35-27-16-31-32(47-19-46-31)17-28(27)37(29-18-45-39(42)36(29)35)40-30-15-26-22-8-4-3-7-20(22)11-12-24(26)23-9-5-6-10-25(23)30/h3-17,29,35-37,40-41H,18-19H2,1-2H3/t29-,35+,36-,37+/m0/s1
    MOLECULAR FORMULA
    C39H31NO7
    CROSS REFERENCES
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    canSAR835578

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 625.21
    AlogP 7.69
    HBond donors 2
    HBond acceptors 8
    Atoms 78
    Contains toxicophore No
    Contains PAINS No
    Commercially available Unknown
    Property color indications are based on Lipinski's Ro5.
    PROTEIN TARGETS
    No information about proteins targeted by canSAR835578.