1127029 logo
canSAR1127029
FEATURES
Loading...
avatar
avatar
avatar
avatar
avatar
avatar
avatar
avatar
avatar
avatar
avatar
NAMES
    SMILES
    COc1ccccc1Cc1cc2c(N)nc(-c3cccc(C#N)c3)nc2s1
    InChI
    InChI=1S/C21H16N4OS/c1-26-18-8-3-2-6-14(18)10-16-11-17-19(23)24-20(25-21(17)27-16)15-7-4-5-13(9-15)12-22/h2-9,11H,10H2,1H3,(H2,23,24,25)
    MOLECULAR FORMULA
    C21H16N4OS
    CROSS REFERENCES
    1127029 logo

    canSAR1127029

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 372.10
    AlogP 4.41
    HBond donors 2
    HBond acceptors 5
    Atoms 43
    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 canSAR1127029.