1964170 logo
canSAR1964170
FEATURES
Loading...
avatar
avatar
avatar
avatar
avatar
avatar
avatar
avatar
avatar
avatar
avatar
NAMES
    SMILES
    CC(C)n1nnnc1C1c2ccccc2C(=O)N1CCc1c[nH]c2ccccc12
    InChI
    InChI=1S/C22H22N6O/c1-14(2)28-21(24-25-26-28)20-17-8-3-4-9-18(17)22(29)27(20)12-11-15-13-23-19-10-6-5-7-16(15)19/h3-10,13-14,20,23H,11-12H2,1-2H3
    MOLECULAR FORMULA
    C22H22N6O
    CROSS REFERENCES
    1964170 logo

    canSAR1964170

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 386.19
    AlogP 3.52
    HBond donors 1
    HBond acceptors 7
    Atoms 51
    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 canSAR1964170.