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

CHEMBL4292518

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
CCOC(=O)C1(Cc2ccccc2)CN(c2ccccc2)Cc2nnn(Cc3ccco3)c21
ChEMBL ↗ Properties Compare Identifier

Basic Information

ChEMBL ID CHEMBL4292518
Phase Preclinical
Structure Type MOL
InChI Key KAYGSVKDJCBGOJ-UHFFFAOYSA-N
0
Targets
0
Activities
0
Assay Types
0
PK Parameters
7
Publications
0
Known Names

Molecular Properties

442.5
MW (Da)
3.98
ALogP
7
HBA
0
HBD
73.4
PSA (Ų)
0.40
QED
0
Ro5 Violations
7
Rot. Bonds

Drug Information

Molecule Type Small molecule
Availability Unknown
Chirality Unknown

Flags

First in Class Prodrug

Extended Properties

Molecular Formula C26H26N4O3
MW 442.52
Aromatic Rings 4
Heavy Atoms 33
NP-Likeness -0.90

Literature References

PubMed DOI Target Context # Activities
30286952 10.1016/j.bmcl.2018.09.019 Unchecked 6
30286952 10.1016/j.bmcl.2018.09.019 Human alphaherpesvirus 1 2
30286952 10.1016/j.bmcl.2018.09.019 Human coronavirus 229E 1
30286952 10.1016/j.bmcl.2018.09.019 HEL 1
30286952 10.1016/j.bmcl.2018.09.019 Human alphaherpesvirus 2 1
30286952 10.1016/j.bmcl.2018.09.019 Vaccinia virus 1
30286952 10.1016/j.bmcl.2018.09.019 Human adenovirus 2 1

Data from ChEMBL 36 via Core Engine