canSAR2160905
FEATURES
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NAMES
    SMILES
    CC(C)(CO)c1ccc(S(=O)(=O)Nc2nc(-c3ncccn3)nc(OCCO)c2Oc2ccccc2O)cc1
    InChI
    InChI=1S/C26H27N5O7S/c1-26(2,16-33)17-8-10-18(11-9-17)39(35,36)31-22-21(38-20-7-4-3-6-19(20)34)25(37-15-14-32)30-24(29-22)23-27-12-5-13-28-23/h3-13,32-34H,14-16H2,1-2H3,(H,29,30,31)
    MOLECULAR FORMULA
    C26H27N5O7S
    CROSS REFERENCES
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    canSAR2160905
    Compound Synopsis
    OVERVIEW
    PROPERTIES
    Molecular weight553.16
    AlogP2.87
    HBond donors4
    HBond acceptors12
    Atoms66
    Contains toxicophoreNo
    Contains PAINSNo
    Commercially availableYes
    Property color indications are based on Lipinski's Ro5.
    PROTEIN TARGETS
    No information about proteins targeted by canSAR2160905.