canSAR2064914
FEATURES
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NAMES
    SMILES
    COc1cccc(OC)c1-c1cc(C(=O)N[C@@H](CCc2ccccc2)CC(=O)O)nn1-c1ccc(F)cc1
    InChI
    InChI=1S/C29H28FN3O5/c1-37-25-9-6-10-26(38-2)28(25)24-18-23(32-33(24)22-15-12-20(30)13-16-22)29(36)31-21(17-27(34)35)14-11-19-7-4-3-5-8-19/h3-10,12-13,15-16,18,21H,11,14,17H2,1-2H3,(H,31,36)(H,34,35)/t21-/m0/s1
    MOLECULAR FORMULA
    C29H28FN3O5
    CROSS REFERENCES
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    canSAR2064914
    Compound Synopsis
    OVERVIEW
    PROPERTIES
    Molecular weight517.20
    AlogP4.90
    HBond donors2
    HBond acceptors8
    Atoms66
    Contains toxicophoreNo
    Contains PAINSNo
    Commercially availableUnknown
    Property color indications are based on Lipinski's Ro5.
    PROTEIN TARGETS
    No information about proteins targeted by canSAR2064914.