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canSAR1859460
FEATURES
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NAMES
    SMILES
    COCCCN1C(=O)C(O)=C(C(=O)c2ccc(S(=O)(=O)N3CCCCC3)cc2)C1c1cccc(OC)c1
    InChI
    InChI=1S/C27H32N2O7S/c1-35-17-7-16-29-24(20-8-6-9-21(18-20)36-2)23(26(31)27(29)32)25(30)19-10-12-22(13-11-19)37(33,34)28-14-4-3-5-15-28/h6,8-13,18,24,31H,3-5,7,14-17H2,1-2H3
    MOLECULAR FORMULA
    C27H32N2O7S
    CROSS REFERENCES
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    canSAR1859460

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 528.19
    AlogP 3.48
    HBond donors 1
    HBond acceptors 9
    Atoms 69
    Contains toxicophore No
    Contains PAINS No
    Commercially available Yes
    Property color indications are based on Lipinski's Ro5.
    PROTEIN TARGETS
    No information about proteins targeted by canSAR1859460.