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Compound Detail

CHEMBL5290669

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NC1CCN(c2c(-c3cc(F)cc(F)c3)cnc3ccc(Cl)cc23)CC1

Basic Information

ChEMBL ID CHEMBL5290669
Phase Preclinical
Structure Type MOL
InChI Key GKMJDDGKJJWAFL-UHFFFAOYSA-N
1
Targets
2
Activities
1
Assay Types
0
PK Parameters
1
Publications
0
Known Names

Molecular Properties

373.8
MW (Da)
4.76
ALogP
3
HBA
1
HBD
42.1
PSA (Ų)
0.70
QED
0
Ro5 Violations
2
Rot. Bonds

Drug Information

Availability Unknown
Chirality Unknown

Flags

First in Class Prodrug

Extended Properties

Molecular Formula C20H18ClF2N3
MW 373.83
Aromatic Rings 3
Heavy Atoms 26
NP-Likeness -1.18

Activity Summary

EC50 2 meas. best 6.24

Target Activity Profile

Target Type Best pChEMBL Mean pChEMBL Best (nM) # Data
Somatostatin receptor type 2
CHEMBL1804
EC50 6.24 6.22 570.0 2

Activity Data Samples

Top measurements by pChEMBL value

Literature References

PubMed DOI Target Context # Activities
36655128 10.1021/acsmedchemlett.2c00431 Somatostatin receptor type 2 2

Data from ChEMBL 36 via Core Engine