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Compound Detail

CHEMBL4065550

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CCCCCCCCCCCCCCCC(=O)N[C@@H](CCC(=O)NCCCC[C@H](NC(=O)[C@H](CO)NC(=O)[C@@H]1CCCN1C(=O)[C@@H]1CCCN1C(=O)[C@@H]1CCCN1C(=O)[C@H](C)NC(=O)CNC(=O)[C@H](CO)NC(=O)[C@H](CO)NC(=O)[C@@H]1CCCN1C(=O)CNC(=O)CNC(=O)[C@H](CC(N)=O)NC(=O)[C@H](CCCCN)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)[C@H](CCC(=O)O)NC(=O)[C@@H](NC(=O)[C@H](Cc1ccccc1)NC(=O)[C@H](CC(=O)O)NC(=O)[C@H](CCC(N)=O)NC(=O)[C@H](C)NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](CO)NC(=O)[C@H](CC(=O)O)NC(=O)[C@H](CCSC)NC(=O)[C@H](CCC(N)=O)NC(=O)[C@H](CCCCN)NC(=O)[C@H](CO)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CC(=O)O)NC(=O)[C@H](CO)NC(=O)[C@@H](NC(=O)[C@H](Cc1ccccc1)NC(=O)[C@@H](NC(=O)CNC(=O)[C@H](CCC(N)=O)NC(=O)[C@H](CO)NC(=O)[C@@H](N)Cc1cnc[nH]1)[C@@H](C)O)[C@H](C)O)[C@@H](C)CC)C(N)=O)C(N)=O

Basic Information

ChEMBL ID CHEMBL4065550
Phase Preclinical
Structure Type MOL
InChI Key KCEYJKYPBKJKRE-GSGNXJCZSA-N
0
Targets
2
Activities
1
Assay Types
4
PK Parameters
3
Publications
0
Known Names

Molecular Properties

4712.3
MW (Da)

Drug Information

Molecule Type Small molecule
Availability Unknown
Chirality Unknown

Flags

First in Class Prodrug

Extended Properties

Molecular Formula C208H329N59O64S
MW 4712.34

Activity Summary

EC50 2 meas.

Pharmacokinetic Data

Parameter Value Units Species
AUC 17000.0 ng.hr.mL-1 Mus musculus
Cmax 732.12 nM Mus musculus
T1/2 2.2 hr Mus musculus
Tmax 2.0 hr Mus musculus

Literature References

PubMed DOI Target Context # Activities
28448133 10.1021/acs.jmedchem.7b00174 Mus musculus 4
28448133 10.1021/acs.jmedchem.7b00174 Glucagon-like peptide 1 receptor 1
28448133 10.1021/acs.jmedchem.7b00174 Glucagon receptor 1

Data from ChEMBL 36 via Core Engine