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canSAR1716016
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NAMES
    SMILES
    Cc1ccc(C2=NNC(=O)C(c3c[nH]c4ccccc34)C2)cc1
    InChI
    InChI=1S/C19H17N3O/c1-12-6-8-13(9-7-12)18-10-15(19(23)22-21-18)16-11-20-17-5-3-2-4-14(16)17/h2-9,11,15,20H,10H2,1H3,(H,22,23)
    MOLECULAR FORMULA
    C19H17N3O
    CROSS REFERENCES
    1716016 logo

    canSAR1716016

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 303.14
    AlogP 3.48
    HBond donors 2
    HBond acceptors 4
    Atoms 40
    Contains toxicophore No
    Contains PAINS No
    Commercially available Yes
    Property color indications are based on Lipinski's Ro5.
    PROTEIN TARGETS
    No information about proteins targeted by canSAR1716016.