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Compound Detail

CHEMBL362799

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CCCN(Cc1c(C)nc2n1CCN2c1c(C)cc(C)cc1C)CC1CC1

Basic Information

ChEMBL ID CHEMBL362799
Phase Preclinical
Structure Type MOL
InChI Key NUSYFZFTXGZARH-UHFFFAOYSA-N
1
Targets
1
Activities
1
Assay Types
0
PK Parameters
1
Publications
0
Known Names

Molecular Properties

366.6
MW (Da)
4.89
ALogP
4
HBA
0
HBD
24.3
PSA (Ų)
0.70
QED
0
Ro5 Violations
7
Rot. Bonds

Drug Information

Molecule Type Small molecule
Availability Unknown
Chirality Unknown

Flags

First in Class Prodrug

Extended Properties

Molecular Formula C23H34N4
MW 366.55
Aromatic Rings 2
Heavy Atoms 27
NP-Likeness -1.54

Activity Summary

Ki 1 meas. best 5.18

Target Activity Profile

Target Type Best pChEMBL Mean pChEMBL Best (nM) # Data
Corticotropin-releasing factor receptor 1
CHEMBL1800
Ki 5.18 5.18 6600.0 1

Activity Data Samples

Top measurements by pChEMBL value

Literature References

PubMed DOI Target Context # Activities
15990298 10.1016/j.bmcl.2005.05.117 Corticotropin-releasing factor receptor 1 1

Data from ChEMBL 36 via Core Engine