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Compound Detail

CHEMBL5880742

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COc1ncc(NC(=O)Nc2cnc3cc(Cl)nn3c2C2(C)CC2)cc1Cl

Basic Information

ChEMBL ID CHEMBL5880742
Phase Preclinical
Structure Type MOL
InChI Key UDPQDLZZYJRTHA-UHFFFAOYSA-N
1
Targets
1
Activities
1
Assay Types
0
PK Parameters
0
Publications
0
Known Names

Molecular Properties

407.3
MW (Da)
4.14
ALogP
6
HBA
2
HBD
93.4
PSA (Ų)
0.68
QED
0
Ro5 Violations
4
Rot. Bonds

Drug Information

Availability Unknown
Chirality Unknown

Flags

First in Class Prodrug

Extended Properties

Molecular Formula C17H16Cl2N6O2
MW 407.26
Aromatic Rings 3
Heavy Atoms 27
NP-Likeness -1.36

Activity Summary

IC50 1 meas. best 10.92

Target Activity Profile

Target Type Best pChEMBL Mean pChEMBL Best (nM) # Data
Mucosa-associated lymphoid tissue lymphoma translocation protein 1
CHEMBL3632452
IC50 10.92 10.92 0.0 1

Activity Data Samples

Top measurements by pChEMBL value

Data from ChEMBL 36 via Core Engine