196073 logo
canSAR196073
FEATURES
Loading...
avatar
avatar
avatar
avatar
avatar
avatar
avatar
avatar
avatar
avatar
avatar
NAMES
    SMILES
    CC(C)(O)C#Cc1nc(-c2ccccc2Cl)c(-c2ccc(Cl)cc2)cc1C#N
    InChI
    InChI=1S/C23H16Cl2N2O/c1-23(2,28)12-11-21-16(14-26)13-19(15-7-9-17(24)10-8-15)22(27-21)18-5-3-4-6-20(18)25/h3-10,13,28H,1-2H3
    MOLECULAR FORMULA
    C23H16Cl2N2O
    CROSS REFERENCES
    196073 logo

    canSAR196073

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 406.06
    AlogP 5.72
    HBond donors 1
    HBond acceptors 3
    Atoms 44
    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 canSAR196073.