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canSAR1591587
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NAMES
    SMILES
    COC(=O)C(CCSC)NC(=O)c1cc2c(n(-c3ccccc3)c1=O)CCCC2=O
    InChI
    InChI=1S/C22H24N2O5S/c1-29-22(28)17(11-12-30-2)23-20(26)16-13-15-18(9-6-10-19(15)25)24(21(16)27)14-7-4-3-5-8-14/h3-5,7-8,13,17H,6,9-12H2,1-2H3,(H,23,26)
    MOLECULAR FORMULA
    C22H24N2O5S
    CROSS REFERENCES
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    canSAR1591587

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 428.14
    AlogP 2.38
    HBond donors 1
    HBond acceptors 7
    Atoms 54
    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 canSAR1591587.