1690654 logo
canSAR1690654
FEATURES
Loading...
avatar
avatar
avatar
avatar
avatar
avatar
avatar
avatar
avatar
avatar
avatar
NAMES
    SMILES
    Cc1ccc(C(=O)N[N-][C+](C)Cn2nnc([N+](=O)[O-])n2)cc1
    InChI
    InChI=1S/C12H13N7O3/c1-8-3-5-10(6-4-8)11(20)14-13-9(2)7-18-16-12(15-17-18)19(21)22/h3-6H,7H2,1-2H3,(H-,13,14,15,16,17,20)
    MOLECULAR FORMULA
    C12H13N7O3
    CROSS REFERENCES
    1690654 logo

    canSAR1690654

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 303.11
    AlogP 1.16
    HBond donors 1
    HBond acceptors 10
    Atoms 35
    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 canSAR1690654.