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

CHEMBL1927035

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
Cc1cc(OC2CCCCC2)nc(Nc2ccc(C#N)cc2)n1
ChEMBL ↗ Properties Compare Identifier

Basic Information

ChEMBL ID CHEMBL1927035
Phase Preclinical
Structure Type MOL
InChI Key CMIQBTASBSWTJZ-UHFFFAOYSA-N
0
Targets
0
Activities
0
Assay Types
0
PK Parameters
4
Publications
0
Known Names

Molecular Properties

308.4
MW (Da)
4.11
ALogP
5
HBA
1
HBD
70.8
PSA (Ų)
0.92
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 C18H20N4O
MW 308.39
Aromatic Rings 2
Heavy Atoms 23
NP-Likeness -1.42

Literature References

PubMed DOI Target Context # Activities
22037050 10.1016/j.bmc.2011.10.002 Human immunodeficiency virus 1 2
22037050 10.1016/j.bmc.2011.10.002 Human immunodeficiency virus 2 1
22037050 10.1016/j.bmc.2011.10.002 MT4 1
22037050 10.1016/j.bmc.2011.10.002 Unchecked 1

Data from ChEMBL 36 via Core Engine