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Compound Detail

CHEMBL5870945

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Cc1cc(C(=O)N2CCC(c3cn([C@H]4CC[C@H](O)CC4)c4nc(N[C@@H](C)c5ccc(F)cc5)ncc34)CC2)cc(C)n1

Basic Information

ChEMBL ID CHEMBL5870945
Phase Preclinical
Structure Type MOL
InChI Key HJRZMYBXJLMXHF-FAQZDJIUSA-N
1
Targets
1
Activities
1
Assay Types
0
PK Parameters
0
Publications
0
Known Names

Molecular Properties

570.7
MW (Da)
6.25
ALogP
7
HBA
2
HBD
96.2
PSA (Ų)
0.28
QED
2
Ro5 Violations
6
Rot. Bonds

Drug Information

Availability Unknown
Chirality Unknown

Flags

First in Class Prodrug

Extended Properties

Molecular Formula C33H39FN6O2
MW 570.71
Aromatic Rings 4
Heavy Atoms 42
NP-Likeness -1.04

Activity Summary

IC50 1 meas. best 6.12

Target Activity Profile

Target Type Best pChEMBL Mean pChEMBL Best (nM) # Data
Tyrosine-protein kinase receptor TYRO3
CHEMBL5314
IC50 6.12 6.12 750.0 1

Activity Data Samples

Top measurements by pChEMBL value

Target Type Rel. Value Units pChEMBL Assay PubMed
Tyrosine-protein kinase receptor TYRO3 IC50 = 750.0 nM 6.12 Activity Assay: Activity Against Tyro3 Tyrosine Kinase. -

Data from ChEMBL 36 via Core Engine