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

CHEMBL3659985

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
O=C(Nc1ccc2[nH]nc(-c3nc4ccccc4[nH]3)c2c1)Nc1ccc(F)cc1F
ChEMBL ↗ Properties Compare Identifier

Basic Information

ChEMBL ID CHEMBL3659985
Phase Preclinical
Structure Type MOL
InChI Key HZUJMAYPJILNGE-UHFFFAOYSA-N
0
Targets
0
Activities
0
Assay Types
0
PK Parameters
1
Publications
0
Known Names

Molecular Properties

404.4
MW (Da)
5.03
ALogP
3
HBA
4
HBD
98.5
PSA (Ų)
0.34
QED
1
Ro5 Violations
3
Rot. Bonds

Drug Information

Molecule Type Small molecule
Availability Unknown
Chirality Unknown

Flags

First in Class Prodrug

Extended Properties

Molecular Formula C21H14F2N6O
MW 404.38
Aromatic Rings 5
Heavy Atoms 30
NP-Likeness -2.07

Literature References

PubMed DOI Target Context # Activities
29150397 10.1016/j.bmcl.2017.10.041 3-phosphoinositide-dependent protein kinase 1 1

Data from ChEMBL 36 via Core Engine