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Compound Detail

CHEMBL5746835

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Cc1cc(C)c2[nH]ccc2c1CN1CCCCC1c1ccc(-c2nn[nH]n2)cc1

Basic Information

ChEMBL ID CHEMBL5746835
Phase Preclinical
Structure Type MOL
InChI Key QJAJIJDEGTUFEF-UHFFFAOYSA-N
1
Targets
2
Activities
1
Assay Types
0
PK Parameters
0
Publications
0
Known Names

Molecular Properties

386.5
MW (Da)
4.69
ALogP
4
HBA
2
HBD
73.5
PSA (Ų)
0.53
QED
0
Ro5 Violations
4
Rot. Bonds

Drug Information

Availability Unknown
Chirality Unknown

Flags

First in Class Prodrug

Extended Properties

Molecular Formula C23H26N6
MW 386.50
Aromatic Rings 4
Heavy Atoms 29
NP-Likeness -1.04

Activity Summary

IC50 2 meas. best 10.4

Target Activity Profile

Target Type Best pChEMBL Mean pChEMBL Best (nM) # Data
Complement factor B
CHEMBL5731
IC50 10.4 8.915 0.0 2

Activity Data Samples

Top measurements by pChEMBL value

Data from ChEMBL 36 via Core Engine