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canSAR1515085
FEATURES
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NAMES
    SMILES
    O=C(Nc1ccc(Nc2ncnc3ccccc23)cc1)Nc1cccc(Br)c1
    InChI
    InChI=1S/C21H16BrN5O/c22-14-4-3-5-17(12-14)27-21(28)26-16-10-8-15(9-11-16)25-20-18-6-1-2-7-19(18)23-13-24-20/h1-13H,(H,23,24,25)(H2,26,27,28)
    MOLECULAR FORMULA
    C21H16BrN5O
    CROSS REFERENCES
    1515085 logo

    canSAR1515085

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 433.05
    AlogP 5.78
    HBond donors 3
    HBond acceptors 6
    Atoms 44
    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 canSAR1515085.