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canSAR1144350
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NAMES
    SMILES
    COc1ccc(-c2nnc(N/N=C/c3ccncc3)nc2-c2ccc(OC)cc2)cc1
    InChI
    InChI=1S/C23H20N6O2/c1-30-19-7-3-17(4-8-19)21-22(18-5-9-20(31-2)10-6-18)27-29-23(26-21)28-25-15-16-11-13-24-14-12-16/h3-15H,1-2H3,(H,26,28,29)/b25-15+
    MOLECULAR FORMULA
    C23H20N6O2
    CROSS REFERENCES
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    canSAR1144350

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 412.16
    AlogP 4.06
    HBond donors 1
    HBond acceptors 8
    Atoms 51
    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 canSAR1144350.