canSAR1809614
FEATURES
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NAMES
    SMILES
    Cn1cnc2cc(-c3ccc(N4CCNCC4)cc3)nc(N3CCC(N=O)C3)c2c1=O
    InChI
    InChI=1S/C22H25N7O2/c1-27-14-24-19-12-18(15-2-4-17(5-3-15)28-10-7-23-8-11-28)25-21(20(19)22(27)30)29-9-6-16(13-29)26-31/h2-5,12,14,16,23H,6-11,13H2,1H3
    MOLECULAR FORMULA
    C22H25N7O2
    CROSS REFERENCES
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    canSAR1809614
    Compound Synopsis
    OVERVIEW
    PROPERTIES
    Molecular weight419.21
    AlogP1.75
    HBond donors1
    HBond acceptors9
    Atoms56
    Contains toxicophoreYes
    Contains PAINSNo
    Commercially availableUnknown
    Property color indications are based on Lipinski's Ro5.
    PROTEIN TARGETS
    No information about proteins targeted by canSAR1809614.