1835946 logo
canSAR1835946
FEATURES
Loading...
avatar
avatar
avatar
avatar
avatar
avatar
avatar
avatar
avatar
avatar
avatar
NAMES
    SMILES
    CCOc1ccc(-n2c(C)cc(/C=N/Nc3nc(C)cc(O)n3)c2C)cc1
    InChI
    InChI=1S/C20H23N5O2/c1-5-27-18-8-6-17(7-9-18)25-14(3)11-16(15(25)4)12-21-24-20-22-13(2)10-19(26)23-20/h6-12H,5H2,1-4H3,(H2,22,23,24,26)/b21-12+
    MOLECULAR FORMULA
    C20H23N5O2
    CROSS REFERENCES
    1835946 logo

    canSAR1835946

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 365.19
    AlogP 3.74
    HBond donors 2
    HBond acceptors 7
    Atoms 50
    Contains toxicophore Yes
    Contains PAINS Yes
    Commercially available Unknown
    Property color indications are based on Lipinski's Ro5.
    PROTEIN TARGETS
    No information about proteins targeted by canSAR1835946.