504170 logo
canSAR504170
FEATURES
Loading...
avatar
avatar
avatar
avatar
avatar
avatar
avatar
avatar
avatar
avatar
avatar
NAMES
    SMILES
    O=C(Nc1cc(Br)ccc1O)c1ccc(CNc2ccncc2)cc1
    InChI
    InChI=1S/C19H16BrN3O2/c20-15-5-6-18(24)17(11-15)23-19(25)14-3-1-13(2-4-14)12-22-16-7-9-21-10-8-16/h1-11,24H,12H2,(H,21,22)(H,23,25)
    MOLECULAR FORMULA
    C19H16BrN3O2
    CROSS REFERENCES
    504170 logo

    canSAR504170

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 397.04
    AlogP 4.41
    HBond donors 3
    HBond acceptors 5
    Atoms 41
    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 canSAR504170.