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canSAR220736
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NAMES
    SMILES
    CN(/N=C/c1cc(Br)ccc1OCc1ccc(Cl)cc1)C1=NCCN1
    InChI
    InChI=1S/C18H18BrClN4O/c1-24(18-21-8-9-22-18)23-11-14-10-15(19)4-7-17(14)25-12-13-2-5-16(20)6-3-13/h2-7,10-11H,8-9,12H2,1H3,(H,21,22)/b23-11+
    MOLECULAR FORMULA
    C18H18BrClN4O
    CROSS REFERENCES
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    canSAR220736

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 420.04
    AlogP 3.91
    HBond donors 1
    HBond acceptors 5
    Atoms 43
    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 canSAR220736.