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Compound Detail

CHEMBL4092313

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N#Cc1cnn2c(NC3CC3)ccnc12
ChEMBL ↗ Properties Compare Identifier

Basic Information

ChEMBL ID CHEMBL4092313
Phase Preclinical
Structure Type MOL
InChI Key IWSWQGBMGDGHGI-UHFFFAOYSA-N
0
Targets
1
Activities
1
Assay Types
0
PK Parameters
1
Publications
0
Known Names

Molecular Properties

199.2
MW (Da)
1.18
ALogP
5
HBA
1
HBD
66.0
PSA (Ų)
0.79
QED
0
Ro5 Violations
2
Rot. Bonds

Drug Information

Molecule Type Small molecule
Availability Unknown
Chirality Unknown

Flags

First in Class Prodrug

Extended Properties

Molecular Formula C10H9N5
MW 199.22
Aromatic Rings 2
Heavy Atoms 15
NP-Likeness -2.32

Activity Summary

Kd 1 meas.

Literature References

PubMed DOI Target Context # Activities
28485934 10.1021/acs.jmedchem.7b00359 B-cell lymphoma 6 protein 2

Data from ChEMBL 36 via Core Engine