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canSAR1970486
FEATURES
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NAMES
    SMILES
    Cc1ccc(S(=O)(=O)c2nc(-c3ccco3)oc2SCC(=O)NCC2CCCO2)cc1
    InChI
    InChI=1S/C21H22N2O6S2/c1-14-6-8-16(9-7-14)31(25,26)20-21(29-19(23-20)17-5-3-11-28-17)30-13-18(24)22-12-15-4-2-10-27-15/h3,5-9,11,15H,2,4,10,12-13H2,1H3,(H,22,24)
    MOLECULAR FORMULA
    C21H22N2O6S2
    CROSS REFERENCES
    1970486 logo

    canSAR1970486

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 462.09
    AlogP 3.46
    HBond donors 1
    HBond acceptors 8
    Atoms 53
    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 canSAR1970486.