1998582 logo
canSAR1998582
FEATURES
Loading...
avatar
avatar
avatar
avatar
avatar
avatar
avatar
avatar
avatar
avatar
avatar
NAMES
    SMILES
    Nc1nc(NCc2ccc(Cl)cc2)nc(NCCO)c1[N+](=O)[O-]
    InChI
    InChI=1S/C13H15ClN6O3/c14-9-3-1-8(2-4-9)7-17-13-18-11(15)10(20(22)23)12(19-13)16-5-6-21/h1-4,21H,5-7H2,(H4,15,16,17,18,19)
    MOLECULAR FORMULA
    C13H15ClN6O3
    CROSS REFERENCES
    1998582 logo

    canSAR1998582

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 338.09
    AlogP 1.64
    HBond donors 5
    HBond acceptors 9
    Atoms 38
    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 canSAR1998582.