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canSAR395993
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NAMES
    SMILES
    CN1CC[C@H](c2ccc(Cl)cc2)[C@H](CSCC(=O)NCc2ccccc2)C1
    InChI
    InChI=1S/C22H27ClN2OS/c1-25-12-11-21(18-7-9-20(23)10-8-18)19(14-25)15-27-16-22(26)24-13-17-5-3-2-4-6-17/h2-10,19,21H,11-16H2,1H3,(H,24,26)/t19-,21+/m0/s1
    MOLECULAR FORMULA
    C22H27ClN2OS
    CROSS REFERENCES
    395993 logo

    canSAR395993

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 402.15
    AlogP 4.42
    HBond donors 1
    HBond acceptors 3
    Atoms 54
    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 canSAR395993.