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canSAR1726503
FEATURES
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NAMES
    SMILES
    CCN(C(=O)COC(=O)c1ccc2[nH]c3c(c2c1)CCCC3)C1CCS(=O)(=O)C1
    InChI
    InChI=1S/C21H26N2O5S/c1-2-23(15-9-10-29(26,27)13-15)20(24)12-28-21(25)14-7-8-19-17(11-14)16-5-3-4-6-18(16)22-19/h7-8,11,15,22H,2-6,9-10,12-13H2,1H3
    MOLECULAR FORMULA
    C21H26N2O5S
    CROSS REFERENCES
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    canSAR1726503

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 418.16
    AlogP 2.24
    HBond donors 1
    HBond acceptors 7
    Atoms 55
    Contains toxicophore No
    Contains PAINS Yes
    Commercially available Yes
    Property color indications are based on Lipinski's Ro5.
    PROTEIN TARGETS
    No information about proteins targeted by canSAR1726503.