1147908 logo
canSAR1147908
FEATURES
Loading...
avatar
avatar
avatar
avatar
avatar
avatar
avatar
avatar
avatar
avatar
avatar
NAMES
    SMILES
    CN(C(=S)NCc1cn(C(=O)OC(C)(C)C)c2ccccc12)c1ccccc1
    InChI
    InChI=1S/C22H25N3O2S/c1-22(2,3)27-21(26)25-15-16(18-12-8-9-13-19(18)25)14-23-20(28)24(4)17-10-6-5-7-11-17/h5-13,15H,14H2,1-4H3,(H,23,28)
    MOLECULAR FORMULA
    C22H25N3O2S
    CROSS REFERENCES
    1147908 logo

    canSAR1147908

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 395.17
    AlogP 4.94
    HBond donors 1
    HBond acceptors 5
    Atoms 53
    Contains toxicophore Yes
    Contains PAINS No
    Commercially available Unknown
    Property color indications are based on Lipinski's Ro5.
    PROTEIN TARGETS
    No information about proteins targeted by canSAR1147908.