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canSAR1129016
FEATURES
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NAMES
    SMILES
    CC1(NC(=O)c2ccc(C#Cc3ccccn3)cn2)COC1
    InChI
    InChI=1S/C17H15N3O2/c1-17(11-22-12-17)20-16(21)15-8-6-13(10-19-15)5-7-14-4-2-3-9-18-14/h2-4,6,8-10H,11-12H2,1H3,(H,20,21)
    MOLECULAR FORMULA
    C17H15N3O2
    CROSS REFERENCES
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    canSAR1129016

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 293.12
    AlogP 1.40
    HBond donors 1
    HBond acceptors 5
    Atoms 37
    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 canSAR1129016.