canSAR2207215
FEATURES
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NAMES
    SMILES
    O=C(Nc1ccc([C@H]2CNCCO2)cc1)c1ccc(Cl)nc1
    InChI
    InChI=1S/C16H16ClN3O2/c17-15-6-3-12(9-19-15)16(21)20-13-4-1-11(2-5-13)14-10-18-7-8-22-14/h1-6,9,14,18H,7-8,10H2,(H,20,21)/t14-/m1/s1
    MOLECULAR FORMULA
    C16H16ClN3O2
    CROSS REFERENCES
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    canSAR2207215
    Compound Synopsis
    OVERVIEW
    PROPERTIES
    Molecular weight317.09
    AlogP2.65
    HBond donors2
    HBond acceptors5
    Atoms38
    Contains toxicophoreYes
    Contains PAINSNo
    Commercially availableUnknown
    Property color indications are based on Lipinski's Ro5.
    PROTEIN TARGETS
    No information about proteins targeted by canSAR2207215.