1149405 logo
canSAR1149405
FEATURES
Loading...
avatar
avatar
avatar
avatar
avatar
avatar
avatar
avatar
avatar
avatar
avatar
NAMES
    SMILES
    CCc1ccc(-c2nc(-c3cc(C)c(OCC(O)CNC(=O)CO)c(C)c3)no2)s1
    InChI
    InChI=1S/C21H25N3O5S/c1-4-16-5-6-17(30-16)21-23-20(24-29-21)14-7-12(2)19(13(3)8-14)28-11-15(26)9-22-18(27)10-25/h5-8,15,25-26H,4,9-11H2,1-3H3,(H,22,27)
    MOLECULAR FORMULA
    C21H25N3O5S
    CROSS REFERENCES
    1149405 logo

    canSAR1149405

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 431.15
    AlogP 2.49
    HBond donors 3
    HBond acceptors 8
    Atoms 55
    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 canSAR1149405.