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canSAR1722001
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NAMES
    SMILES
    Cc1c(N[S+](=O)([O-])c2ccc(CCCCC3CCNCC3)cc2)c(CC(C)C)nn1C
    InChI
    InChI=1S/C24H38N4O2S/c1-18(2)17-23-24(19(3)28(4)26-23)27-31(29,30)22-11-9-20(10-12-22)7-5-6-8-21-13-15-25-16-14-21/h9-12,18,21,25H,5-8,13-17H2,1-4H3,(H-,27,29,30)
    MOLECULAR FORMULA
    C24H38N4O2S
    CROSS REFERENCES
    1722001 logo

    canSAR1722001

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 446.27
    AlogP 4.66
    HBond donors 2
    HBond acceptors 6
    Atoms 69
    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 canSAR1722001.