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canSAR465773
FEATURES
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NAMES
    SMILES
    CC(C)[C@H](NC(=O)COc1cccc2ccccc12)C(=O)N[C@@H](CC(=O)O)C(=O)COc1cccc(C(F)(F)F)c1
    InChI
    InChI=1S/C29H29F3N2O7/c1-17(2)27(34-25(36)16-41-24-12-5-8-18-7-3-4-11-21(18)24)28(39)33-22(14-26(37)38)23(35)15-40-20-10-6-9-19(13-20)29(30,31)32/h3-13,17,22,27H,14-16H2,1-2H3,(H,33,39)(H,34,36)(H,37,38)/t22-,27-/m0/s1
    MOLECULAR FORMULA
    C29H29F3N2O7
    CROSS REFERENCES
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    canSAR465773

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 574.19
    AlogP 3.99
    HBond donors 3
    HBond acceptors 9
    Atoms 70
    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 canSAR465773.