canSAR2095916
FEATURES
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NAMES
    SMILES
    COc1ccc(-n2cc(CN3CCN(c4noc5cc(Cl)ccc45)CC3)nn2)cc1
    InChI
    InChI=1S/C21H21ClN6O2/c1-29-18-5-3-17(4-6-18)28-14-16(23-25-28)13-26-8-10-27(11-9-26)21-19-7-2-15(22)12-20(19)30-24-21/h2-7,12,14H,8-11,13H2,1H3
    MOLECULAR FORMULA
    C21H21ClN6O2
    CROSS REFERENCES
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    canSAR2095916
    Compound Synopsis
    OVERVIEW
    PROPERTIES
    Molecular weight424.14
    AlogP3.39
    HBond donors0
    HBond acceptors8
    Atoms51
    Contains toxicophoreNo
    Contains PAINSNo
    Commercially availableUnknown
    Property color indications are based on Lipinski's Ro5.
    PROTEIN TARGETS
    No information about proteins targeted by canSAR2095916.