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Compound Detail

CHEMBL1590944

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O=C(O)CCNc1nc(-c2ccccc2)c2cc(Br)ccc2n1

Basic Information

ChEMBL ID CHEMBL1590944
Phase Preclinical
Structure Type MOL
InChI Key RDOHZEGBSDXWQZ-UHFFFAOYSA-N
1
Targets
1
Activities
1
Assay Types
0
PK Parameters
0
Publications
0
Known Names

Molecular Properties

372.2
MW (Da)
3.95
ALogP
4
HBA
2
HBD
75.1
PSA (Ų)
0.71
QED
0
Ro5 Violations
5
Rot. Bonds

Drug Information

Molecule Type Small molecule
Availability Unknown
Chirality Unknown

Flags

First in Class Prodrug

Extended Properties

Molecular Formula C17H14BrN3O2
MW 372.22
Aromatic Rings 3
Heavy Atoms 23
NP-Likeness -1.06

Activity Summary

EC50 1 meas. best 5.62

Target Activity Profile

Target Type Best pChEMBL Mean pChEMBL Best (nM) # Data
Corticotropin-releasing factor receptor 2/Corticotropin-releasing factor-binding protein
CHEMBL3885546
EC50 5.62 5.62 2380.0 1

Activity Data Samples

Top measurements by pChEMBL value

Data from ChEMBL 36 via Core Engine