Skip to main content
Free research Free research Free compound review with research home and workspace preview
Quick search ChEMBL 36
Compound Detail

CHEMBL359784

Enter ChEMBL ID:
Free Research Context This compound will appear in recent viewed items on the research home for this browser.
Research home View demo workspace
CCCN(CCC)c1cc(C)nc2c(-c3cnc(C)cc3C)c(C)nn12

Basic Information

ChEMBL ID CHEMBL359784
Phase Preclinical
Structure Type MOL
InChI Key POQVTQKEODEAOZ-UHFFFAOYSA-N
1
Targets
1
Activities
1
Assay Types
0
PK Parameters
1
Publications
0
Known Names

Molecular Properties

351.5
MW (Da)
4.65
ALogP
5
HBA
0
HBD
46.3
PSA (Ų)
0.65
QED
0
Ro5 Violations
6
Rot. Bonds

Drug Information

Molecule Type Small molecule
Availability Unknown
Chirality Unknown

Flags

First in Class Prodrug

Extended Properties

Molecular Formula C21H29N5
MW 351.50
Aromatic Rings 3
Heavy Atoms 26
NP-Likeness -1.30

Activity Summary

Ki 1 meas. best 8.14

Target Activity Profile

Target Type Best pChEMBL Mean pChEMBL Best (nM) # Data
Corticotropin-releasing factor receptor 1
CHEMBL1800
Ki 8.14 8.14 7.3 1

Activity Data Samples

Top measurements by pChEMBL value

Literature References

PubMed DOI Target Context # Activities
15341493 10.1021/jm040058e Corticotropin-releasing factor receptor 1 1

Data from ChEMBL 36 via Core Engine