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canSAR1973361
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NAMES
    SMILES
    C=C1CCN([C@@H](CC(C)C)C(=O)N2CCCC2)S(=O)(=O)c2ccccc21
    InChI
    InChI=1S/C20H28N2O3S/c1-15(2)14-18(20(23)21-11-6-7-12-21)22-13-10-16(3)17-8-4-5-9-19(17)26(22,24)25/h4-5,8-9,15,18H,3,6-7,10-14H2,1-2H3/t18-/m0/s1
    MOLECULAR FORMULA
    C20H28N2O3S
    CROSS REFERENCES
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    canSAR1973361

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 376.18
    AlogP 3.13
    HBond donors 0
    HBond acceptors 5
    Atoms 54
    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 canSAR1973361.