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canSAR831670
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NAMES
    SMILES
    CN1C(=O)C[C@H](c2ccccc2)[C@@H]1[C@H](O)c1ccc(-c2ccc(Cl)cc2)s1
    InChI
    InChI=1S/C22H20ClNO2S/c1-24-20(25)13-17(14-5-3-2-4-6-14)21(24)22(26)19-12-11-18(27-19)15-7-9-16(23)10-8-15/h2-12,17,21-22,26H,13H2,1H3/t17-,21-,22-/m1/s1
    MOLECULAR FORMULA
    C22H20ClNO2S
    CROSS REFERENCES
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    canSAR831670

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 397.09
    AlogP 5.12
    HBond donors 1
    HBond acceptors 3
    Atoms 47
    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 canSAR831670.