1769580 logo
canSAR1769580
FEATURES
Loading...
avatar
avatar
avatar
avatar
avatar
avatar
avatar
avatar
avatar
avatar
avatar
NAMES
    SMILES
    O=C(Nc1cccc(C(=O)OCc2cc(=O)n3nc(C4CC4)sc3n2)c1)c1cccc(F)c1
    InChI
    InChI=1S/C23H17FN4O4S/c24-16-5-1-3-14(9-16)20(30)25-17-6-2-4-15(10-17)22(31)32-12-18-11-19(29)28-23(26-18)33-21(27-28)13-7-8-13/h1-6,9-11,13H,7-8,12H2,(H,25,30)
    MOLECULAR FORMULA
    C23H17FN4O4S
    CROSS REFERENCES
    1769580 logo

    canSAR1769580

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 464.10
    AlogP 3.78
    HBond donors 1
    HBond acceptors 8
    Atoms 50
    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 canSAR1769580.