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Compound Detail

CHEMBL1974582

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N#Cc1cccc(Nc2ncnc(Nc3ccc(F)cc3)n2)c1

Basic Information

ChEMBL ID CHEMBL1974582
Phase Preclinical
Structure Type MOL
InChI Key DDIWACSQAYVQBC-UHFFFAOYSA-N
1
Targets
1
Activities
1
Assay Types
0
PK Parameters
0
Publications
0
Known Names

Molecular Properties

306.3
MW (Da)
3.37
ALogP
6
HBA
2
HBD
86.5
PSA (Ų)
0.77
QED
0
Ro5 Violations
4
Rot. Bonds

Drug Information

Molecule Type Small molecule
Availability Unknown
Chirality Unknown

Flags

First in Class Prodrug

Extended Properties

Molecular Formula C16H11FN6
MW 306.30
Aromatic Rings 3
Heavy Atoms 23
NP-Likeness -1.86

Activity Summary

Ki 1 meas. best 7.0

Target Activity Profile

Target Type Best pChEMBL Mean pChEMBL Best (nM) # Data
Cell division cycle 7-related protein kinase
CHEMBL5443
Ki 7.0 7.0 100.0 1

Activity Data Samples

Top measurements by pChEMBL value

Data from ChEMBL 36 via Core Engine