canSAR546811
FEATURES
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NAMES
    SMILES
    Cl.N#CCOc1ccc(CCN2CCC(Nc3nc4ccccc4n3Cc3ccc(F)cc3)CC2)cc1
    InChI
    InChI=1S/C29H30FN5O.ClH/c30-24-9-5-23(6-10-24)21-35-28-4-2-1-3-27(28)33-29(35)32-25-14-18-34(19-15-25)17-13-22-7-11-26(12-8-22)36-20-16-31;/h1-12,25H,13-15,17-21H2,(H,32,33);1H
    MOLECULAR FORMULA
    C29H31ClFN5O
    CROSS REFERENCES
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    canSAR546811
    Compound Synopsis
    OVERVIEW
    PROPERTIES
    Molecular weight519.22
    AlogP5.67
    HBond donors1
    HBond acceptors6
    Atoms68
    Contains toxicophoreYes
    Contains PAINSNo
    Commercially availableUnknown
    Property color indications are based on Lipinski's Ro5.
    PROTEIN TARGETS
    No information about proteins targeted by canSAR546811.