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canSAR1858987
FEATURES
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NAMES
    SMILES
    COc1ccc2c3c([nH]c2c1)[C@H](CO)N(C(=O)c1ccccc1)CC31CN(S(=O)(=O)c2cccs2)C1
    InChI
    InChI=1S/C26H25N3O5S2/c1-34-18-9-10-19-20(12-18)27-24-21(13-30)29(25(31)17-6-3-2-4-7-17)16-26(23(19)24)14-28(15-26)36(32,33)22-8-5-11-35-22/h2-12,21,27,30H,13-16H2,1H3/t21-/m0/s1
    MOLECULAR FORMULA
    C26H25N3O5S2
    CROSS REFERENCES
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    canSAR1858987

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 523.12
    AlogP 3.37
    HBond donors 2
    HBond acceptors 8
    Atoms 61
    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 canSAR1858987.