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canSAR1128887
FEATURES
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NAMES
    SMILES
    CCc1c(C(=O)NCCc2ccc(N(C)C)cc2)oc2ccc(Cl)cc12
    InChI
    InChI=1S/C21H23ClN2O2/c1-4-17-18-13-15(22)7-10-19(18)26-20(17)21(25)23-12-11-14-5-8-16(9-6-14)24(2)3/h5-10,13H,4,11-12H2,1-3H3,(H,23,25)
    MOLECULAR FORMULA
    C21H23ClN2O2
    CROSS REFERENCES
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    canSAR1128887

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 370.14
    AlogP 4.69
    HBond donors 1
    HBond acceptors 4
    Atoms 49
    Contains toxicophore No
    Contains PAINS Yes
    Commercially available Unknown
    Property color indications are based on Lipinski's Ro5.
    PROTEIN TARGETS
    No information about proteins targeted by canSAR1128887.