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canSAR2052318
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NAMES
    SMILES
    Cl.N#Cc1cccc(Cn2cc(CCN)c3ccccc32)c1
    InChI
    InChI=1S/C18H17N3.ClH/c19-9-8-16-13-21(18-7-2-1-6-17(16)18)12-15-5-3-4-14(10-15)11-20;/h1-7,10,13H,8-9,12,19H2;1H
    MOLECULAR FORMULA
    C18H18ClN3
    CROSS REFERENCES
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    canSAR2052318

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 311.12
    AlogP 3.48
    HBond donors 2
    HBond acceptors 3
    Atoms 40
    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 canSAR2052318.