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canSAR2048884
FEATURES
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NAMES
    SMILES
    COc1ccc(S(=O)(=O)NCC(C)(C)c2cccc3ccccc23)cc1N1CCNCC1
    InChI
    InChI=1S/C25H31N3O3S/c1-25(2,22-10-6-8-19-7-4-5-9-21(19)22)18-27-32(29,30)20-11-12-24(31-3)23(17-20)28-15-13-26-14-16-28/h4-12,17,26-27H,13-16,18H2,1-3H3
    MOLECULAR FORMULA
    C25H31N3O3S
    CROSS REFERENCES
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    canSAR2048884

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 453.21
    AlogP 3.51
    HBond donors 2
    HBond acceptors 6
    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 canSAR2048884.