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canSAR2002849
FEATURES
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NAMES
    SMILES
    C[C@@H](CO)N1C[C@@H](C)[C@H](CN(C)S(=O)(=O)c2ccc(Cl)cc2)Oc2c(NC(=O)C3CCOCC3)cccc2C1=O
    InChI
    InChI=1S/C28H36ClN3O7S/c1-18-15-32(19(2)17-33)28(35)23-5-4-6-24(30-27(34)20-11-13-38-14-12-20)26(23)39-25(18)16-31(3)40(36,37)22-9-7-21(29)8-10-22/h4-10,18-20,25,33H,11-17H2,1-3H3,(H,30,34)/t18-,19+,25+/m1/s1
    MOLECULAR FORMULA
    C28H36ClN3O7S
    CROSS REFERENCES
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    canSAR2002849

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 593.20
    AlogP 3.25
    HBond donors 2
    HBond acceptors 10
    Atoms 76
    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 canSAR2002849.