canSAR1711437
FEATURES
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NAMES
    SMILES
    O=C(c1nc2ccccc2[nH]1)N1CC(c2nccnc2N2CCCCC2)C1
    InChI
    InChI=1S/C20H22N6O/c27-20(18-23-15-6-2-3-7-16(15)24-18)26-12-14(13-26)17-19(22-9-8-21-17)25-10-4-1-5-11-25/h2-3,6-9,14H,1,4-5,10-13H2,(H,23,24)
    MOLECULAR FORMULA
    C20H22N6O
    CROSS REFERENCES
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    canSAR1711437
    Compound Synopsis
    OVERVIEW
    PROPERTIES
    Molecular weight362.19
    AlogP2.58
    HBond donors1
    HBond acceptors7
    Atoms49
    Contains toxicophoreNo
    Contains PAINSNo
    Commercially availableUnknown
    Property color indications are based on Lipinski's Ro5.
    PROTEIN TARGETS
    No information about proteins targeted by canSAR1711437.