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Compound Detail

CHEMBL2204283

MSD-M1PAM-NC
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N#CC1(c2ccccn2)CCN(Cc2cc(C(=O)N3CCCC3)c(=O)n3ccccc23)CC1

Basic Information

ChEMBL ID CHEMBL2204283
Name MSD-M1PAM-NC
Phase Preclinical
Structure Type MOL
InChI Key ASAKPTPDFNXOQN-UHFFFAOYSA-N
0
Targets
0
Activities
0
Assay Types
0
PK Parameters
20
Publications
0
Known Names

Molecular Properties

441.5
MW (Da)
2.99
ALogP
6
HBA
0
HBD
81.7
PSA (Ų)
0.62
QED
0
Ro5 Violations
4
Rot. Bonds

Drug Information

Molecule Type Small molecule
Availability Unknown
Chirality Unknown

Flags

First in Class Prodrug

Extended Properties

Molecular Formula C26H27N5O2
MW 441.54
Aromatic Rings 3
Heavy Atoms 33
NP-Likeness -1.33

Literature References

PubMed DOI Target Context # Activities
- 10.6019/CHEMBL4507295 Tyrosine-protein kinase ABL1 15
- 10.6019/CHEMBL5674860 Colon cancer organoid 12
- 10.6019/CHEMBL5724558 Colon cancer organoid 12
- 10.6019/CHEMBL4507295 Epidermal growth factor receptor 12
- 10.6019/CHEMBL4507295 Receptor-type tyrosine-protein kinase FLT3 11
- 10.6019/CHEMBL4689842 HEK-293T 10
- 10.6019/CHEMBL4507295 Phosphatidylinositol 4,5-bisphosphate 3-kinase catalytic subunit alpha isoform 10
- 10.6019/CHEMBL4507295 Mast/stem cell growth factor receptor Kit 9
- 10.6019/CHEMBL4689842 Fibroblast 8
- 10.6019/CHEMBL4507295 Unchecked 8
- 10.6019/CHEMBL5608141 Colon cancer organoid 6
- 10.6019/CHEMBL4689842 U2OS 5
- 10.1158/2159-8290.CD-23-0050 Colon cancer organoid 5
- 10.6019/CHEMBL4507295 Proto-oncogene tyrosine-protein kinase receptor Ret 4
- 10.6019/CHEMBL4507295 ALK tyrosine kinase receptor 3
- 10.6019/CHEMBL4507295 Hepatocyte growth factor receptor 3
- 10.6019/CHEMBL4507295 Tyrosine-protein kinase JAK1 2
- 10.6019/CHEMBL4507295 Macrophage colony-stimulating factor 1 receptor 2
- 10.6019/CHEMBL4507295 Ribosomal protein S6 kinase alpha-5 2
- 10.6019/CHEMBL4507295 Ribosomal protein S6 kinase alpha-4 2

Data from ChEMBL 36 via Core Engine