660825 logo
canSAR660825
FEATURES
Loading...
avatar
avatar
avatar
avatar
avatar
avatar
avatar
avatar
avatar
avatar
avatar
NAMES
    SMILES
    Brc1cccc(Nc2ncnc3cc4c(cc23)OCCCO4)c1
    InChI
    InChI=1S/C17H14BrN3O2/c18-11-3-1-4-12(7-11)21-17-13-8-15-16(23-6-2-5-22-15)9-14(13)19-10-20-17/h1,3-4,7-10H,2,5-6H2,(H,19,20,21)
    MOLECULAR FORMULA
    C17H14BrN3O2
    CROSS REFERENCES
    660825 logo

    canSAR660825

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 371.03
    AlogP 4.30
    HBond donors 1
    HBond acceptors 5
    Atoms 37
    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 canSAR660825.