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Compound Detail

CHEMBL6012099

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COCCNc1cc(NC(=O)N2CCCc3cc(CN(C=O)C[C@H]4CCCO4)c(C=O)nc32)ncc1C#N

Basic Information

ChEMBL ID CHEMBL6012099
Phase Preclinical
Structure Type MOL
InChI Key WHBJNPYTHQVTSZ-OAQYLSRUSA-N
1
Targets
1
Activities
1
Assay Types
0
PK Parameters
0
Publications
0
Known Names

Molecular Properties

521.6
MW (Da)
2.34
ALogP
9
HBA
2
HBD
149.8
PSA (Ų)
0.34
QED
1
Ro5 Violations
11
Rot. Bonds

Drug Information

Availability Unknown
Chirality Unknown

Flags

First in Class Prodrug

Extended Properties

Molecular Formula C26H31N7O5
MW 521.58
Aromatic Rings 2
Heavy Atoms 38
NP-Likeness -1.16

Activity Summary

IC50 1 meas. best 8.37

Target Activity Profile

Target Type Best pChEMBL Mean pChEMBL Best (nM) # Data
Fibroblast growth factor receptor 4
CHEMBL3973
IC50 8.37 8.37 4.3 1

Activity Data Samples

Top measurements by pChEMBL value

Data from ChEMBL 36 via Core Engine