canSAR2225230
FEATURES
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NAMES
    SMILES
    CCC(=O)N1CC[C@H](Oc2ccc3c(c2)N(c2cnc(Cl)c(C)c2)CCO3)C1
    InChI
    InChI=1S/C21H24ClN3O3/c1-3-20(26)24-7-6-17(13-24)28-16-4-5-19-18(11-16)25(8-9-27-19)15-10-14(2)21(22)23-12-15/h4-5,10-12,17H,3,6-9,13H2,1-2H3/t17-/m0/s1
    MOLECULAR FORMULA
    C21H24ClN3O3
    CROSS REFERENCES
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    canSAR2225230
    Compound Synopsis
    OVERVIEW
    PROPERTIES
    Molecular weight401.15
    AlogP3.96
    HBond donors0
    HBond acceptors6
    Atoms52
    Contains toxicophoreYes
    Contains PAINSNo
    Commercially availableUnknown
    Property color indications are based on Lipinski's Ro5.
    PROTEIN TARGETS
    No information about proteins targeted by canSAR2225230.