canSAR1746752
FEATURES
Loading...
NAMES
    SMILES
    COc1cc(/C=C/C(=O)OCC(=O)NC(=O)NC2CCCC2)ccc1OCC#N
    InChI
    InChI=1S/C20H23N3O6/c1-27-17-12-14(6-8-16(17)28-11-10-21)7-9-19(25)29-13-18(24)23-20(26)22-15-4-2-3-5-15/h6-9,12,15H,2-5,11,13H2,1H3,(H2,22,23,24,26)/b9-7+
    MOLECULAR FORMULA
    C20H23N3O6
    CROSS REFERENCES
    Loading...
    canSAR1746752
    Compound Synopsis
    OVERVIEW
    PROPERTIES
    Molecular weight401.16
    AlogP1.92
    HBond donors2
    HBond acceptors9
    Atoms52
    Contains toxicophoreYes
    Contains PAINSNo
    Commercially availableYes
    Property color indications are based on Lipinski's Ro5.
    PROTEIN TARGETS
    No information about proteins targeted by canSAR1746752.