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

CHEMBL5631422

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
CC1(C)CN(C(=O)c2cc(Cc3n[nH]c(=O)c4ccccc34)ccc2F)Cc2cnnn21
ChEMBL ↗ Properties Compare Identifier

Basic Information

ChEMBL ID CHEMBL5631422
Phase Preclinical
Structure Type MOL
InChI Key JKLPLPHGROORAP-UHFFFAOYSA-N
0
Targets
0
Activities
0
Assay Types
0
PK Parameters
1
Publications
0
Known Names

Molecular Properties

432.5
MW (Da)
2.64
ALogP
6
HBA
1
HBD
96.8
PSA (Ų)
0.54
QED
0
Ro5 Violations
3
Rot. Bonds

Drug Information

Availability Unknown
Chirality Unknown

Flags

First in Class Prodrug

Extended Properties

Molecular Formula C23H21FN6O2
MW 432.46
Aromatic Rings 4
Heavy Atoms 32
NP-Likeness -1.47

Literature References

PubMed DOI Target Context # Activities
37567056 10.1016/j.ejmech.2023.115709 Poly [ADP-ribose] polymerase 1 1

Data from ChEMBL 36 via Core Engine