2021688 logo
canSAR2021688
FEATURES
Loading...
avatar
avatar
avatar
avatar
avatar
avatar
avatar
avatar
avatar
avatar
avatar
NAMES
    SMILES
    Cc1c(Cl)c([N+](=O)[O-])nn1Cc1ccc(C(=O)N/[NH+]=C/c2cc(Cl)ccc2[O-])o1
    InChI
    InChI=1S/C17H13Cl2N5O5/c1-9-15(19)16(24(27)28)22-23(9)8-12-3-5-14(29-12)17(26)21-20-7-10-6-11(18)2-4-13(10)25/h2-7,25H,8H2,1H3,(H,21,26)/b20-7+
    MOLECULAR FORMULA
    C17H13Cl2N5O5
    CROSS REFERENCES
    2021688 logo

    canSAR2021688

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 437.03
    AlogP 0.97
    HBond donors 2
    HBond acceptors 10
    Atoms 42
    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 canSAR2021688.