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canSAR1522941
FEATURES
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NAMES
    SMILES
    CC(C)NCC#CCOc1ccc(Cl)cc1
    InChI
    InChI=1S/C13H16ClNO/c1-11(2)15-9-3-4-10-16-13-7-5-12(14)6-8-13/h5-8,11,15H,9-10H2,1-2H3
    MOLECULAR FORMULA
    C13H16ClNO
    CROSS REFERENCES
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    canSAR1522941

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 237.09
    AlogP 2.72
    HBond donors 1
    HBond acceptors 2
    Atoms 32
    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 canSAR1522941.