1060963 logo
canSAR1060963
FEATURES
Loading...
avatar
avatar
avatar
avatar
avatar
avatar
avatar
avatar
avatar
avatar
avatar
NAMES
    SMILES
    O=C(Nc1cc(Br)ccn1)Nc1cccc2c1C1CCCCN1C2=O
    InChI
    InChI=1S/C18H17BrN4O2/c19-11-7-8-20-15(10-11)22-18(25)21-13-5-3-4-12-16(13)14-6-1-2-9-23(14)17(12)24/h3-5,7-8,10,14H,1-2,6,9H2,(H2,20,21,22,25)
    MOLECULAR FORMULA
    C18H17BrN4O2
    CROSS REFERENCES
    1060963 logo

    canSAR1060963

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 400.05
    AlogP 4.17
    HBond donors 2
    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 canSAR1060963.