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canSAR1131144
FEATURES
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NAMES
    SMILES
    COc1ccc(CCNS(=O)(=O)c2ccc(-n3cc(COc4ccc([N+](=O)[O-])cc4)nn3)cc2)cc1OC
    InChI
    InChI=1S/C25H25N5O7S/c1-35-24-12-3-18(15-25(24)36-2)13-14-26-38(33,34)23-10-6-20(7-11-23)29-16-19(27-28-29)17-37-22-8-4-21(5-9-22)30(31)32/h3-12,15-16,26H,13-14,17H2,1-2H3
    MOLECULAR FORMULA
    C25H25N5O7S
    CROSS REFERENCES
    1131144 logo

    canSAR1131144

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 539.15
    AlogP 3.29
    HBond donors 1
    HBond acceptors 12
    Atoms 63
    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 canSAR1131144.