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canSAR1059216
FEATURES
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NAMES
    SMILES
    CC(C)C[C@H](C(N)=O)N(CCCCCCN1CCOCC1)S(=O)(=O)c1ccc(Cl)cc1
    InChI
    InChI=1S/C22H36ClN3O4S/c1-18(2)17-21(22(24)27)26(31(28,29)20-9-7-19(23)8-10-20)12-6-4-3-5-11-25-13-15-30-16-14-25/h7-10,18,21H,3-6,11-17H2,1-2H3,(H2,24,27)/t21-/m1/s1
    MOLECULAR FORMULA
    C22H36ClN3O4S
    CROSS REFERENCES
    1059216 logo

    canSAR1059216

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 473.21
    AlogP 3.12
    HBond donors 2
    HBond acceptors 7
    Atoms 67
    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 canSAR1059216.