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

CHEMBL3676154

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
O=C(O)C[C@@H](Cc1ccc(-c2cccc(Cl)c2)cc1)NC(=O)c1nn[nH]n1
ChEMBL ↗ Properties Compare Identifier

Basic Information

ChEMBL ID CHEMBL3676154
Phase Preclinical
Structure Type MOL
InChI Key AGMDDGBZRAZZDC-OAHLLOKOSA-N
1
Targets
2
Activities
1
Assay Types
0
PK Parameters
0
Publications
0
Known Names

Molecular Properties

385.8
MW (Da)
2.34
ALogP
5
HBA
3
HBD
120.9
PSA (Ų)
0.57
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 C18H16ClN5O3
MW 385.81
Aromatic Rings 3
Heavy Atoms 27
NP-Likeness -0.90

Activity Summary

IC50 2 meas. best 8.92

Target Activity Profile

Target Type Best pChEMBL Mean pChEMBL Best (nM) # Data
Membrane metallo-endopeptidase-like 1
CHEMBL3638356
 IC50 8.92 8.92 1.2 2

Activity Data Samples

Top measurements by pChEMBL value

Target Type Rel. Value Units pChEMBL Assay PubMed
Membrane metallo-endopeptidase-like 1 IC50 = 1.2 nM 8.92 Inhibition Assay: Recombinant human neutral endopeptidase (expressed in insect c... -
Membrane metallo-endopeptidase-like 1 IC50 = 1.2 nM 8.92 Inhibition Assay: Recombinant human neutral endopeptidase (expressed in insect c... -

Data from ChEMBL 36 via Core Engine