canSAR2065087
FEATURES
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NAMES
    SMILES
    COc1ccccc1-c1nc2c(NCC3CCN(C)CC3)c(Cl)cnc2[nH]1
    InChI
    InChI=1S/C20H24ClN5O/c1-26-9-7-13(8-10-26)11-22-17-15(21)12-23-20-18(17)24-19(25-20)14-5-3-4-6-16(14)27-2/h3-6,12-13H,7-11H2,1-2H3,(H2,22,23,24,25)
    MOLECULAR FORMULA
    C20H24ClN5O
    CROSS REFERENCES
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    canSAR2065087
    Compound Synopsis
    OVERVIEW
    PROPERTIES
    Molecular weight385.17
    AlogP4.04
    HBond donors2
    HBond acceptors6
    Atoms51
    Contains toxicophoreNo
    Contains PAINSNo
    Commercially availableUnknown
    Property color indications are based on Lipinski's Ro5.
    PROTEIN TARGETS
    No information about proteins targeted by canSAR2065087.