canSAR282562
FEATURES
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NAMES
    SMILES
    N[C@@H](Cc1ccccc1)C(=O)OC[C@@H]1S[C@H](CC=O)S[C@@H]1COC(=O)[C@@H](N)Cc1ccccc1
    InChI
    InChI=1S/C25H30N2O5S2/c26-19(13-17-7-3-1-4-8-17)24(29)31-15-21-22(34-23(33-21)11-12-28)16-32-25(30)20(27)14-18-9-5-2-6-10-18/h1-10,12,19-23H,11,13-16,26-27H2/t19-,20-,21-,22+,23-/m0/s1
    MOLECULAR FORMULA
    C25H30N2O5S2
    CROSS REFERENCES
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    canSAR282562
    Compound Synopsis
    OVERVIEW
    PROPERTIES
    Molecular weight502.16
    AlogP2.35
    HBond donors4
    HBond acceptors7
    Atoms64
    Contains toxicophoreYes
    Contains PAINSNo
    Commercially availableUnknown
    Property color indications are based on Lipinski's Ro5.
    PROTEIN TARGETS
    No information about proteins targeted by canSAR282562.