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canSAR500534
FEATURES
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NAMES
    SMILES
    CCCS(=O)(=O)N1CCC(N2CCC(C3(c4ccc([S+]([O-])c5ccc6c(c5)OCO6)cc4)SCCS3)CC2)CC1
    InChI
    InChI=1S/C29H38N2O5S4/c1-2-19-40(33,34)31-15-11-24(12-16-31)30-13-9-23(10-14-30)29(37-17-18-38-29)22-3-5-25(6-4-22)39(32)26-7-8-27-28(20-26)36-21-35-27/h3-8,20,23-24H,2,9-19,21H2,1H3
    MOLECULAR FORMULA
    C29H38N2O5S4
    CROSS REFERENCES
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    canSAR500534

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 622.17
    AlogP 5.13
    HBond donors 0
    HBond acceptors 7
    Atoms 78
    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 canSAR500534.