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canSAR66176
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NAMES
    SMILES
    C[C@H](CNc1cccc(CNC(=O)NS(=O)(=O)c2ccccc2)c1)NC[C@H](O)c1cccc(Cl)c1
    InChI
    InChI=1S/C25H29ClN4O4S/c1-18(27-17-24(31)20-8-6-9-21(26)14-20)15-28-22-10-5-7-19(13-22)16-29-25(32)30-35(33,34)23-11-3-2-4-12-23/h2-14,18,24,27-28,31H,15-17H2,1H3,(H2,29,30,32)/t18-,24+/m1/s1
    MOLECULAR FORMULA
    C25H29ClN4O4S
    CROSS REFERENCES
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    canSAR66176

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 516.16
    AlogP 3.65
    HBond donors 5
    HBond acceptors 8
    Atoms 64
    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 canSAR66176.