canSAR1647500
FEATURES
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NAMES
    SMILES
    Cc1cc(Oc2ccccc2)nc(OCC#N)n1
    InChI
    InChI=1S/C13H11N3O2/c1-10-9-12(16-13(15-10)17-8-7-14)18-11-5-3-2-4-6-11/h2-6,9H,8H2,1H3
    MOLECULAR FORMULA
    C13H11N3O2
    CROSS REFERENCES
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    canSAR1647500
    Compound Synopsis
    OVERVIEW
    PROPERTIES
    Molecular weight241.09
    AlogP2.48
    HBond donors0
    HBond acceptors5
    Atoms29
    Contains toxicophoreYes
    Contains PAINSNo
    Commercially availableYes
    Property color indications are based on Lipinski's Ro5.
    PROTEIN TARGETS
    No information about proteins targeted by canSAR1647500.