1769459 logo
canSAR1769459
FEATURES
Loading...
avatar
avatar
avatar
avatar
avatar
avatar
avatar
avatar
avatar
avatar
avatar
NAMES
    SMILES
    COc1ccccc1NC(=O)CSc1nc(N)c(C#N)cc1C#N
    InChI
    InChI=1S/C16H13N5O2S/c1-23-13-5-3-2-4-12(13)20-14(22)9-24-16-11(8-18)6-10(7-17)15(19)21-16/h2-6H,9H2,1H3,(H2,19,21)(H,20,22)
    MOLECULAR FORMULA
    C16H13N5O2S
    CROSS REFERENCES
    1769459 logo

    canSAR1769459

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 339.08
    AlogP 2.15
    HBond donors 3
    HBond acceptors 7
    Atoms 37
    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 canSAR1769459.