canSAR1746321
FEATURES
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NAMES
    SMILES
    O=C1OC[C@@H]2CCCN2C(=O)[C@@H](CC(=O)N(CCO)Cc2ccccc2)C/C=C\C[C@@H]1Cc1ccc(F)cc1
    InChI
    InChI=1S/C31H37FN2O5/c32-27-14-12-23(13-15-27)19-26-10-5-4-9-25(30(37)34-16-6-11-28(34)22-39-31(26)38)20-29(36)33(17-18-35)21-24-7-2-1-3-8-24/h1-5,7-8,12-15,25-26,28,35H,6,9-11,16-22H2/b5-4-/t25-,26-,28+/m1/s1
    MOLECULAR FORMULA
    C31H37FN2O5
    CROSS REFERENCES
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    canSAR1746321
    Compound Synopsis
    OVERVIEW
    PROPERTIES
    Molecular weight536.27
    AlogP3.90
    HBond donors1
    HBond acceptors7
    Atoms76
    Contains toxicophoreNo
    Contains PAINSNo
    Commercially availableUnknown
    Property color indications are based on Lipinski's Ro5.
    PROTEIN TARGETS
    No information about proteins targeted by canSAR1746321.