Skip to main content
Free research Free research Free compound review with research home and workspace preview
Quick search ChEMBL 36
Compound Detail

CHEMBL2115404

Enter ChEMBL ID:
Free Research Context This compound will appear in recent viewed items on the research home for this browser.
Research home View demo workspace
Cc1cn([C@@H]2O[C@H](CO)[C@@H](N=[N+]=[N-])[C@H]2F)c(=O)[nH]c1=O
ChEMBL ↗ Properties Compare Identifier

Basic Information

ChEMBL ID CHEMBL2115404
Phase Preclinical
Structure Type MOL
InChI Key AVYGFRQPURLSLQ-JXOAFFINSA-N
0
Targets
4
Activities
2
Assay Types
0
PK Parameters
7
Publications
0
Known Names

Molecular Properties

285.2
MW (Da)
-0.25
ALogP
6
HBA
2
HBD
133.1
PSA (Ų)
0.45
QED
0
Ro5 Violations
3
Rot. Bonds

Drug Information

Molecule Type Small molecule
Availability Unknown
Chirality Unknown

Flags

First in Class Prodrug

Extended Properties

Molecular Formula C10H12FN5O4
MW 285.24
Aromatic Rings 1
Heavy Atoms 20
NP-Likeness 0.68

Activity Summary

EC50 2 meas.
IC50 2 meas.

Literature References

PubMed DOI Target Context # Activities
1695683 10.1021/jm00170a016 Unchecked 4
1695683 10.1021/jm00170a016 MT4 3
2033590 10.1021/jm00109a017 HL-60 2
2165162 10.1021/jm00170a017 CCRF-CEM 2
2033590 10.1021/jm00109a017 H9 1
7520081 10.1021/jm00042a005 Human immunodeficiency virus type 1 reverse transcriptase 1
1695683 10.1021/jm00170a016 HL-60 1

Data from ChEMBL 36 via Core Engine