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Compound Detail

CHEMBL5984128

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CO[C@H]1CCN(c2cc(NC(=O)N3CCCc4cc(CN5CC[C@H](OC)C5=O)c(C=O)nc43)ncc2C#N)C1

Basic Information

ChEMBL ID CHEMBL5984128
Phase Preclinical
Structure Type MOL
InChI Key LFTRUGBNIVGOGN-REWPJTCUSA-N
1
Targets
1
Activities
1
Assay Types
0
PK Parameters
0
Publications
0
Known Names

Molecular Properties

533.6
MW (Da)
2.12
ALogP
9
HBA
1
HBD
141.0
PSA (Ų)
0.53
QED
1
Ro5 Violations
7
Rot. Bonds

Drug Information

Availability Unknown
Chirality Unknown

Flags

First in Class Prodrug

Extended Properties

Molecular Formula C27H31N7O5
MW 533.59
Aromatic Rings 2
Heavy Atoms 39
NP-Likeness -0.89

Activity Summary

IC50 1 meas. best 8.14

Target Activity Profile

Target Type Best pChEMBL Mean pChEMBL Best (nM) # Data
Fibroblast growth factor receptor 4
CHEMBL3973
IC50 8.14 8.14 7.2 1

Activity Data Samples

Top measurements by pChEMBL value

Data from ChEMBL 36 via Core Engine