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canSAR11297
FEATURES
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NAMES
    SMILES
    CCC1CCN(C(=O)C(CCCN=C(N)N)NS(=O)(=O)c2cccc3c(OC(C)C)cccc23)CC1
    InChI
    InChI=1S/C26H39N5O4S/c1-4-19-13-16-31(17-14-19)25(32)22(10-7-15-29-26(27)28)30-36(33,34)24-12-6-8-20-21(24)9-5-11-23(20)35-18(2)3/h5-6,8-9,11-12,18-19,22,30H,4,7,10,13-17H2,1-3H3,(H4,27,28,29)
    MOLECULAR FORMULA
    C26H39N5O4S
    CROSS REFERENCES
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    canSAR11297

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 517.27
    AlogP 2.98
    HBond donors 5
    HBond acceptors 9
    Atoms 75
    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 canSAR11297.