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canSAR1968688
FEATURES
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NAMES
    SMILES
    CC(=O)Nc1ccc(SCC(c2ccccc2)N2CCN(C)CCC2=O)cc1
    InChI
    InChI=1S/C22H27N3O2S/c1-17(26)23-19-8-10-20(11-9-19)28-16-21(18-6-4-3-5-7-18)25-15-14-24(2)13-12-22(25)27/h3-11,21H,12-16H2,1-2H3,(H,23,26)
    MOLECULAR FORMULA
    C22H27N3O2S
    CROSS REFERENCES
    1968688 logo

    canSAR1968688

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 397.18
    AlogP 3.64
    HBond donors 1
    HBond acceptors 5
    Atoms 55
    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 canSAR1968688.