501798 logo
canSAR501798
FEATURES
Loading...
avatar
avatar
avatar
avatar
avatar
avatar
avatar
avatar
avatar
avatar
avatar
NAMES
    SMILES
    COc1ccc2c(c1)COC(=O)N2C1CCN(CC(=O)Nc2ccc3ncccc3c2)CC1
    InChI
    InChI=1S/C25H26N4O4/c1-32-21-5-7-23-18(14-21)16-33-25(31)29(23)20-8-11-28(12-9-20)15-24(30)27-19-4-6-22-17(13-19)3-2-10-26-22/h2-7,10,13-14,20H,8-9,11-12,15-16H2,1H3,(H,27,30)
    MOLECULAR FORMULA
    C25H26N4O4
    CROSS REFERENCES
    501798 logo

    canSAR501798

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 446.20
    AlogP 3.80
    HBond donors 1
    HBond acceptors 8
    Atoms 59
    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 canSAR501798.