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Compound Detail

CHEMBL256701

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C#Cc1c(CCNc2cc[nH]c(=O)c2-c2nc3c(C)cc(N4CCOCC4)cc3[nH]2)ncn1CC

Basic Information

ChEMBL ID CHEMBL256701
Phase Preclinical
Structure Type MOL
InChI Key NUTQCENVKDJPDR-UHFFFAOYSA-N
1
Targets
2
Activities
1
Assay Types
0
PK Parameters
1
Publications
0
Known Names

Molecular Properties

471.6
MW (Da)
2.92
ALogP
7
HBA
3
HBD
103.9
PSA (Ų)
0.36
QED
0
Ro5 Violations
7
Rot. Bonds

Drug Information

Molecule Type Small molecule
Availability Unknown
Chirality Unknown

Flags

First in Class Prodrug

Extended Properties

Molecular Formula C26H29N7O2
MW 471.57
Aromatic Rings 4
Heavy Atoms 35
NP-Likeness -1.16

Activity Summary

IC50 2 meas. best 6.61

Target Activity Profile

Target Type Best pChEMBL Mean pChEMBL Best (nM) # Data
Insulin-like growth factor 1 receptor
CHEMBL1957
IC50 6.61 6.15 243.0 2

Activity Data Samples

Top measurements by pChEMBL value

Literature References

PubMed DOI Target Context # Activities
18258427 10.1016/j.bmcl.2008.01.049 Insulin-like growth factor 1 receptor 2

Data from ChEMBL 36 via Core Engine