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Compound Detail

CHEMBL5863724

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N=C(N)c1ccc(CNC(=O)[C@@H]2CCN2C(=O)C2CCCN2)cc1

Basic Information

ChEMBL ID CHEMBL5863724
Phase Preclinical
Structure Type MOL
InChI Key OZNFKJCRCCRVFH-KZUDCZAMSA-N
1
Targets
1
Activities
1
Assay Types
0
PK Parameters
0
Publications
0
Known Names

Molecular Properties

329.4
MW (Da)
-0.06
ALogP
4
HBA
4
HBD
111.3
PSA (Ų)
0.45
QED
0
Ro5 Violations
5
Rot. Bonds

Drug Information

Availability Unknown
Chirality Unknown

Flags

First in Class Prodrug

Extended Properties

Molecular Formula C17H23N5O2
MW 329.40
Aromatic Rings 1
Heavy Atoms 24
NP-Likeness -0.62

Activity Summary

Ki 1 meas. best 5.82

Target Activity Profile

Target Type Best pChEMBL Mean pChEMBL Best (nM) # Data
Mannan-binding lectin serine protease 2
CHEMBL4295646
Ki 5.82 5.82 1500.0 1

Activity Data Samples

Top measurements by pChEMBL value

Data from ChEMBL 36 via Core Engine