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canSAR987059
FEATURES
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NAMES
    SMILES
    C=CCOC(=O)N[C@H](Cc1ccccc1)[C@@H](O)CN1C[C@H](C)Cc2ccccc2S1(=O)=O
    InChI
    InChI=1S/C24H30N2O5S/c1-3-13-31-24(28)25-21(15-19-9-5-4-6-10-19)22(27)17-26-16-18(2)14-20-11-7-8-12-23(20)32(26,29)30/h3-12,18,21-22,27H,1,13-17H2,2H3,(H,25,28)/t18-,21-,22+/m1/s1
    MOLECULAR FORMULA
    C24H30N2O5S
    CROSS REFERENCES
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    canSAR987059

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 458.19
    AlogP 2.75
    HBond donors 2
    HBond acceptors 7
    Atoms 62
    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 canSAR987059.