1447078 logo
canSAR1447078
FEATURES
Loading...
avatar
avatar
avatar
avatar
avatar
avatar
avatar
avatar
avatar
avatar
avatar
NAMES
    SMILES
    O=C(Nc1ccc2nc(C3CC3)n(Cc3ccccc3)c(=O)c2c1)C1CC1
    InChI
    InChI=1S/C22H21N3O2/c26-21(16-8-9-16)23-17-10-11-19-18(12-17)22(27)25(20(24-19)15-6-7-15)13-14-4-2-1-3-5-14/h1-5,10-12,15-16H,6-9,13H2,(H,23,26)
    MOLECULAR FORMULA
    C22H21N3O2
    CROSS REFERENCES
    1447078 logo

    canSAR1447078

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 359.16
    AlogP 3.67
    HBond donors 1
    HBond acceptors 5
    Atoms 48
    Contains toxicophore No
    Contains PAINS No
    Commercially available Yes
    Property color indications are based on Lipinski's Ro5.
    PROTEIN TARGETS
    No information about proteins targeted by canSAR1447078.