canSAR1533872
FEATURES
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NAMES
    SMILES
    COc1cc(C(=O)N/C(=C\c2cn(S(=O)(=O)N(C)C)c3ccccc23)C(=O)NCCCO)cc(OC)c1OC
    InChI
    InChI=1S/C26H32N4O8S/c1-29(2)39(34,35)30-16-18(19-9-6-7-10-21(19)30)13-20(26(33)27-11-8-12-31)28-25(32)17-14-22(36-3)24(38-5)23(15-17)37-4/h6-7,9-10,13-16,31H,8,11-12H2,1-5H3,(H,27,33)(H,28,32)/b20-13-
    MOLECULAR FORMULA
    C26H32N4O8S
    CROSS REFERENCES
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    canSAR1533872
    Compound Synopsis
    OVERVIEW
    PROPERTIES
    Molecular weight560.19
    AlogP1.59
    HBond donors3
    HBond acceptors12
    Atoms71
    Contains toxicophoreYes
    Contains PAINSNo
    Commercially availableYes
    Property color indications are based on Lipinski's Ro5.
    PROTEIN TARGETS
    No information about proteins targeted by canSAR1533872.