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Compound Detail

CHEMBL6057145

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CCN1CCC[C@@H]1C(=O)N(C)Cc1cc2c(nc1C=O)N(C(=O)Nc1cc(NCCOC)c(C#N)cn1)CCC2

Basic Information

ChEMBL ID CHEMBL6057145
Phase Preclinical
Structure Type MOL
InChI Key KMGPDJRZQZMYQL-XMMPIXPASA-N
1
Targets
1
Activities
1
Assay Types
0
PK Parameters
0
Publications
0
Known Names

Molecular Properties

548.6
MW (Da)
2.65
ALogP
9
HBA
2
HBD
143.8
PSA (Ų)
0.34
QED
1
Ro5 Violations
10
Rot. Bonds

Drug Information

Availability Unknown
Chirality Unknown

Flags

First in Class Prodrug

Extended Properties

Molecular Formula C28H36N8O4
MW 548.65
Aromatic Rings 2
Heavy Atoms 40
NP-Likeness -1.45

Activity Summary

IC50 1 meas. best 8.83

Target Activity Profile

Target Type Best pChEMBL Mean pChEMBL Best (nM) # Data
Fibroblast growth factor receptor 4
CHEMBL3973
IC50 8.83 8.83 1.5 1

Activity Data Samples

Top measurements by pChEMBL value

Data from ChEMBL 36 via Core Engine