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canSAR2208033
FEATURES
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NAMES
    SMILES
    COc1ccc(F)c(-c2ncc(COc3cccc([C@@H](CC(=O)O)C4CC4)c3)nc2-c2ccc(C)s2)c1
    InChI
    InChI=1S/C29H27FN2O4S/c1-17-6-11-26(37-17)29-28(24-13-21(35-2)9-10-25(24)30)31-15-20(32-29)16-36-22-5-3-4-19(12-22)23(14-27(33)34)18-7-8-18/h3-6,9-13,15,18,23H,7-8,14,16H2,1-2H3,(H,33,34)/t23-/m0/s1
    MOLECULAR FORMULA
    C29H27FN2O4S
    CROSS REFERENCES
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    canSAR2208033

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 518.17
    AlogP 6.88
    HBond donors 1
    HBond acceptors 6
    Atoms 64
    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 canSAR2208033.