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canSAR988399
FEATURES
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NAMES
    SMILES
    CCc1cc2c(cc1OS(N)(=O)=O)CC[C@@H]1[C@@H]2CC[C@@]2(C)[C@H]1CC[C@@H]2CCOS(N)(=O)=O
    InChI
    InChI=1S/C22H34N2O6S2/c1-3-14-12-19-15(13-21(14)30-32(24,27)28)4-6-18-17(19)8-10-22(2)16(5-7-20(18)22)9-11-29-31(23,25)26/h12-13,16-18,20H,3-11H2,1-2H3,(H2,23,25,26)(H2,24,27,28)/t16-,17+,18-,20+,22-/m1/s1
    MOLECULAR FORMULA
    C22H34N2O6S2
    CROSS REFERENCES
    988399 logo

    canSAR988399

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 486.19
    AlogP 2.91
    HBond donors 4
    HBond acceptors 8
    Atoms 66
    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 canSAR988399.