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Compound Detail

CHEMBL23648

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CN1CCC(CNCCCCNCC2CCN(C(=O)Cc3cccc4ccccc34)CC2)CC1

Basic Information

ChEMBL ID CHEMBL23648
Phase Preclinical
Structure Type MOL
InChI Key OVHSIVJGWBFUNV-UHFFFAOYSA-N
1
Targets
1
Activities
1
Assay Types
0
PK Parameters
2
Publications
0
Known Names

Molecular Properties

464.7
MW (Da)
3.92
ALogP
4
HBA
2
HBD
47.6
PSA (Ų)
0.50
QED
0
Ro5 Violations
11
Rot. Bonds

Drug Information

Molecule Type Small molecule
Availability Unknown
Chirality Unknown

Flags

First in Class Prodrug

Extended Properties

Molecular Formula C29H44N4O
MW 464.70
Aromatic Rings 2
Heavy Atoms 34
NP-Likeness -0.70

Activity Summary

IC50 1 meas. best 6.24

Target Activity Profile

Target Type Best pChEMBL Mean pChEMBL Best (nM) # Data
Glutamate receptor ionotropic, AMPA
CHEMBL2093871
IC50 6.24 6.24 570.0 1

Activity Data Samples

Top measurements by pChEMBL value

Literature References

PubMed DOI Target Context # Activities
11392532 10.1016/s0960-894x(01)00170-6 Glutamate receptor ionotropic, AMPA 1
11392532 10.1016/s0960-894x(01)00170-6 Rattus norvegicus 1

Data from ChEMBL 36 via Core Engine