552103 logo
canSAR552103
FEATURES
Loading...
avatar
avatar
avatar
avatar
avatar
avatar
avatar
avatar
avatar
avatar
avatar
NAMES
    SMILES
    COc1cc2c(Nc3cccc(Br)c3)ncnc2c(OC)c1OC.Cl
    InChI
    InChI=1S/C17H16BrN3O3.ClH/c1-22-13-8-12-14(16(24-3)15(13)23-2)19-9-20-17(12)21-11-6-4-5-10(18)7-11;/h4-9H,1-3H3,(H,19,20,21);1H
    MOLECULAR FORMULA
    C17H17BrClN3O3
    CROSS REFERENCES
    552103 logo

    canSAR552103

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 425.01
    AlogP 4.58
    HBond donors 1
    HBond acceptors 6
    Atoms 42
    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 canSAR552103.