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

CHEMBL233832

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
COc1cc2c(cc1CN1CCN(C)CC1)Cc1c(-c3ccc(-c4ccc(O)c(C#N)c4)cc3)n[nH]c1-2
ChEMBL ↗ Properties Compare Identifier

Basic Information

ChEMBL ID CHEMBL233832
Phase Preclinical
Structure Type MOL
InChI Key HGQOPAMOCLATRZ-UHFFFAOYSA-N
0
Targets
0
Activities
0
Assay Types
0
PK Parameters
1
Publications
0
Known Names

Molecular Properties

491.6
MW (Da)
4.65
ALogP
6
HBA
2
HBD
88.4
PSA (Ų)
0.37
QED
0
Ro5 Violations
5
Rot. Bonds

Drug Information

Molecule Type Small molecule
Availability Unknown
Chirality Unknown

Flags

First in Class Prodrug

Extended Properties

Molecular Formula C30H29N5O2
MW 491.60
Aromatic Rings 4
Heavy Atoms 37
NP-Likeness -0.71

Literature References

PubMed DOI Target Context # Activities
17490879 10.1016/j.bmcl.2007.04.055 Serine/threonine-protein kinase Chk1 1

Data from ChEMBL 36 via Core Engine