canSAR1503534
FEATURES
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NAMES
    SMILES
    Nc1nc(N)c2c(OCC3CCN(c4ccccc4Cl)CC3)cccc2n1
    InChI
    InChI=1S/C20H22ClN5O/c21-14-4-1-2-6-16(14)26-10-8-13(9-11-26)12-27-17-7-3-5-15-18(17)19(22)25-20(23)24-15/h1-7,13H,8-12H2,(H4,22,23,24,25)
    MOLECULAR FORMULA
    C20H22ClN5O
    CROSS REFERENCES
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    canSAR1503534
    Compound Synopsis
    OVERVIEW
    PROPERTIES
    Molecular weight383.15
    AlogP3.74
    HBond donors4
    HBond acceptors6
    Atoms49
    Contains toxicophoreNo
    Contains PAINSNo
    Commercially availableUnknown
    Property color indications are based on Lipinski's Ro5.
    PROTEIN TARGETS
    No information about proteins targeted by canSAR1503534.