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canSAR1636480
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NAMES
    SMILES
    Cn1c(-c2ccccc2)cnc1NCc1cc(Cl)ccc1O
    InChI
    InChI=1S/C17H16ClN3O/c1-21-15(12-5-3-2-4-6-12)11-20-17(21)19-10-13-9-14(18)7-8-16(13)22/h2-9,11,22H,10H2,1H3,(H,19,20)
    MOLECULAR FORMULA
    C17H16ClN3O
    CROSS REFERENCES
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    canSAR1636480

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 313.10
    AlogP 4.06
    HBond donors 2
    HBond acceptors 4
    Atoms 38
    Contains toxicophore No
    Contains PAINS Yes
    Commercially available Yes
    Property color indications are based on Lipinski's Ro5.
    PROTEIN TARGETS
    No information about proteins targeted by canSAR1636480.