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canSAR2002354
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NAMES
    SMILES
    CCCCNc1n[n+](C)c(-c2cccc(C)c2)s1.[Cl-]
    InChI
    InChI=1S/C14H20N3S.ClH/c1-4-5-9-15-14-16-17(3)13(18-14)12-8-6-7-11(2)10-12;/h6-8,10H,4-5,9H2,1-3H3,(H,15,16);1H/q+1;/p-1
    MOLECULAR FORMULA
    C14H20ClN3S
    CROSS REFERENCES
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    canSAR2002354

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 297.11
    AlogP 0.16
    HBond donors 1
    HBond acceptors 3
    Atoms 39
    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 canSAR2002354.