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canSAR1433234
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NAMES
    SMILES
    COC(=O)CCCC1=CC2=CC(=O)C(C)(OC(=O)c3cccs3)C(=O)C2=CN1Cc1ccccc1
    InChI
    InChI=1S/C27H25NO6S/c1-27(34-26(32)22-11-7-13-35-22)23(29)15-19-14-20(10-6-12-24(30)33-2)28(17-21(19)25(27)31)16-18-8-4-3-5-9-18/h3-5,7-9,11,13-15,17H,6,10,12,16H2,1-2H3
    MOLECULAR FORMULA
    C27H25NO6S
    CROSS REFERENCES
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    canSAR1433234

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 491.14
    AlogP 4.37
    HBond donors 0
    HBond acceptors 7
    Atoms 60
    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 canSAR1433234.