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canSAR1518297
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NAMES
    SMILES
    OCc1cccc(Nc2cc3ccc(-c4ccccc4Cl)nc3cn2)c1
    InChI
    InChI=1S/C21H16ClN3O/c22-18-7-2-1-6-17(18)19-9-8-15-11-21(23-12-20(15)25-19)24-16-5-3-4-14(10-16)13-26/h1-12,26H,13H2,(H,23,24)
    MOLECULAR FORMULA
    C21H16ClN3O
    CROSS REFERENCES
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    canSAR1518297

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 361.10
    AlogP 5.19
    HBond donors 2
    HBond acceptors 4
    Atoms 42
    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 canSAR1518297.