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canSAR1122626
FEATURES
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NAMES
    SMILES
    COc1ccc(CNc2ccnc(-c3cccc(OC)c3)n2)cc1
    InChI
    InChI=1S/C19H19N3O2/c1-23-16-8-6-14(7-9-16)13-21-18-10-11-20-19(22-18)15-4-3-5-17(12-15)24-2/h3-12H,13H2,1-2H3,(H,20,21,22)
    MOLECULAR FORMULA
    C19H19N3O2
    CROSS REFERENCES
    1122626 logo

    canSAR1122626

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 321.15
    AlogP 3.77
    HBond donors 1
    HBond acceptors 5
    Atoms 43
    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 canSAR1122626.