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canSAR1829121
FEATURES
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NAMES
    SMILES
    COc1ccc(OCC(=O)N(Cc2ccco2)C2CCS(=O)(=O)C2)cc1
    InChI
    InChI=1S/C18H21NO6S/c1-23-15-4-6-16(7-5-15)25-12-18(20)19(11-17-3-2-9-24-17)14-8-10-26(21,22)13-14/h2-7,9,14H,8,10-13H2,1H3
    MOLECULAR FORMULA
    C18H21NO6S
    CROSS REFERENCES
    1829121 logo

    canSAR1829121

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 379.11
    AlogP 1.88
    HBond donors 0
    HBond acceptors 7
    Atoms 47
    Contains toxicophore No
    Contains PAINS No
    Commercially available Yes
    Property color indications are based on Lipinski's Ro5.
    PROTEIN TARGETS
    No information about proteins targeted by canSAR1829121.