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canSAR1979409
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NAMES
    SMILES
    COc1ccc(C=Nn2cnc3c([nH]c4ccc(Br)cc43)c2=O)cc1CN1CCOCC1
    InChI
    InChI=1S/C23H22BrN5O3/c1-31-20-5-2-15(10-16(20)13-28-6-8-32-9-7-28)12-26-29-14-25-21-18-11-17(24)3-4-19(18)27-22(21)23(29)30/h2-5,10-12,14,27H,6-9,13H2,1H3
    MOLECULAR FORMULA
    C23H22BrN5O3
    CROSS REFERENCES
    1979409 logo

    canSAR1979409

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 495.09
    AlogP 3.36
    HBond donors 1
    HBond acceptors 8
    Atoms 54
    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 canSAR1979409.