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Compound Detail

CHEMBL3681264

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Cc1nc2cc(-n3ncc(C(=O)C4=CC5C=CC(C#N)=CC5N4)c3N)ccc2[nH]1

Basic Information

ChEMBL ID CHEMBL3681264
Phase Preclinical
Structure Type MOL
InChI Key IRVNUYFGIYEUAJ-UHFFFAOYSA-N
3
Targets
3
Activities
1
Assay Types
0
PK Parameters
0
Publications
0
Known Names

Molecular Properties

383.4
MW (Da)
2.31
ALogP
7
HBA
3
HBD
125.4
PSA (Ų)
0.60
QED
0
Ro5 Violations
3
Rot. Bonds

Drug Information

Molecule Type Small molecule
Availability Unknown
Chirality Unknown

Flags

First in Class Prodrug

Extended Properties

Molecular Formula C21H17N7O
MW 383.42
Aromatic Rings 3
Heavy Atoms 29
NP-Likeness -1.01

Activity Summary

IC50 3 meas. best 8.21

Target Activity Profile

Target Type Best pChEMBL Mean pChEMBL Best (nM) # Data
Fibroblast growth factor receptor 2
CHEMBL4142
IC50 8.21 8.21 6.2 1
Fibroblast growth factor receptor 1
CHEMBL3650
IC50 8.05 8.05 9.0 1
Fibroblast growth factor receptor 3
CHEMBL2742
IC50 7.5 7.5 32.0 1

Activity Data Samples

Top measurements by pChEMBL value

Data from ChEMBL 36 via Core Engine