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canSAR1618082
FEATURES
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NAMES
    SMILES
    CCCS(=O)(=O)N(CCOc1ccc2c(c1)C(Cc1ccccc1)C(NC(=O)OCC)CC2)C1CC1
    InChI
    InChI=1S/C28H38N2O5S/c1-3-18-36(32,33)30(23-12-13-23)16-17-35-24-14-10-22-11-15-27(29-28(31)34-4-2)26(25(22)20-24)19-21-8-6-5-7-9-21/h5-10,14,20,23,26-27H,3-4,11-13,15-19H2,1-2H3,(H,29,31)
    MOLECULAR FORMULA
    C28H38N2O5S
    CROSS REFERENCES
    1618082 logo

    canSAR1618082

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 514.25
    AlogP 4.66
    HBond donors 1
    HBond acceptors 7
    Atoms 74
    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 canSAR1618082.