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canSAR393682
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NAMES
    SMILES
    CNC(=O)[C@H](Cc1ccccc1)NC(=O)[C@@H](Cc1ccccc1S)CC(C)C
    InChI
    InChI=1S/C23H30N2O2S/c1-16(2)13-19(15-18-11-7-8-12-21(18)28)22(26)25-20(23(27)24-3)14-17-9-5-4-6-10-17/h4-12,16,19-20,28H,13-15H2,1-3H3,(H,24,27)(H,25,26)/t19-,20+/m1/s1
    MOLECULAR FORMULA
    C23H30N2O2S
    CROSS REFERENCES
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    canSAR393682

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 398.20
    AlogP 3.65
    HBond donors 2
    HBond acceptors 4
    Atoms 58
    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 canSAR393682.