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

CHEMBL6037657

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
C[C@H]1CN(C)C(C)(C)CN1C(=O)N1Cc2c(Nc3ccnc(N(C)C)n3)n[nH]c2C1(C)C

Basic Information

ChEMBL ID CHEMBL6037657
Phase Preclinical
Structure Type MOL
InChI Key RSBIYYBKMTVJFZ-AWEZNQCLSA-N
2
Targets
2
Activities
1
Assay Types
0
PK Parameters
0
Publications
0
Known Names

Molecular Properties

441.6
MW (Da)
2.59
ALogP
7
HBA
2
HBD
96.5
PSA (Ų)
0.76
QED
0
Ro5 Violations
3
Rot. Bonds

Drug Information

Availability Unknown
Chirality Unknown

Flags

First in Class Prodrug

Extended Properties

Molecular Formula C22H35N9O
MW 441.58
Aromatic Rings 2
Heavy Atoms 32
NP-Likeness -0.74

Activity Summary

Ki 2 meas. best 8.01

Target Activity Profile

Target Type Best pChEMBL Mean pChEMBL Best (nM) # Data
Protein kinase C beta type
CHEMBL3045
Ki 8.01 8.01 9.7 1
Unchecked
CHEMBL612545
Ki 8.01 8.01 9.7 1

Activity Data Samples

Top measurements by pChEMBL value

Data from ChEMBL 36 via Core Engine