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

CHEMBL69566

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
CC1Cn2c(S)nc3cc(Cl)cc(c32)CN1CC1CC1

Basic Information

ChEMBL ID CHEMBL69566
Phase Preclinical
Structure Type MOL
InChI Key DCTURVKYYUBBDN-UHFFFAOYSA-N
1
Targets
1
Activities
1
Assay Types
0
PK Parameters
1
Publications
0
Known Names

Molecular Properties

307.9
MW (Da)
3.59
ALogP
4
HBA
1
HBD
21.1
PSA (Ų)
0.86
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 C15H18ClN3S
MW 307.85
Aromatic Rings 2
Heavy Atoms 20
NP-Likeness -1.24

Activity Summary

IC50 1 meas. best 7.47

Target Activity Profile

Target Type Best pChEMBL Mean pChEMBL Best (nM) # Data
Human immunodeficiency virus type 1 reverse transcriptase
CHEMBL247
IC50 7.47 7.47 34.0 1

Activity Data Samples

Top measurements by pChEMBL value

Literature References

PubMed DOI Target Context # Activities
8667357 10.1021/jm950589q Human immunodeficiency virus type 1 reverse transcriptase 1

Data from ChEMBL 36 via Core Engine