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canSAR347805
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NAMES
    SMILES
    CC(C(=O)N1CCN(C)CC1)c1ccc2c(c1)SCC1CCCCC1C2=O
    InChI
    InChI=1S/C22H30N2O2S/c1-15(22(26)24-11-9-23(2)10-12-24)16-7-8-19-20(13-16)27-14-17-5-3-4-6-18(17)21(19)25/h7-8,13,15,17-18H,3-6,9-12,14H2,1-2H3
    MOLECULAR FORMULA
    C22H30N2O2S
    CROSS REFERENCES
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    canSAR347805

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 386.20
    AlogP 3.66
    HBond donors 0
    HBond acceptors 4
    Atoms 57
    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 canSAR347805.