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canSAR1128774
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NAMES
    SMILES
    COCCNc1nc(-c2cccc(C(=O)O)c2)cnc1N
    InChI
    InChI=1S/C14H16N4O3/c1-21-6-5-16-13-12(15)17-8-11(18-13)9-3-2-4-10(7-9)14(19)20/h2-4,7-8H,5-6H2,1H3,(H2,15,17)(H,16,18)(H,19,20)
    MOLECULAR FORMULA
    C14H16N4O3
    CROSS REFERENCES
    1128774 logo

    canSAR1128774

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 288.12
    AlogP 1.48
    HBond donors 4
    HBond acceptors 7
    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 canSAR1128774.