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Compound Detail

CHEMBL3823994

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

Basic Information

ChEMBL ID CHEMBL3823994
Phase Preclinical
Structure Type MOL
InChI Key ULEKKHMGJXHNOB-WUWMMSSFSA-N
1
Targets
1
Activities
1
Assay Types
1
PK Parameters
5
Publications
0
Known Names

Molecular Properties

3475.9
MW (Da)

Drug Information

Molecule Type Small molecule
Availability Unknown
Chirality Unknown

Flags

First in Class Prodrug

Extended Properties

Molecular Formula C158H236N42O47
MW 3475.87

Activity Summary

EC50 1 meas. best 9.82

Target Activity Profile

Target Type Best pChEMBL Mean pChEMBL Best (nM) # Data
Glucagon-like peptide 2 receptor
CHEMBL5844
EC50 9.82 9.82 0.1 1

Pharmacokinetic Data

Parameter Value Units Species
CL 0.5 mL.min-1.kg-1 Rattus norvegicus

Activity Data Samples

Top measurements by pChEMBL value

Literature References

PubMed DOI Target Context # Activities
26986178 10.1021/acs.jmedchem.5b01909 Glucagon-like peptide 2 receptor 1
26986178 10.1021/acs.jmedchem.5b01909 Glucagon-like peptide 1 receptor 1
26986178 10.1021/acs.jmedchem.5b01909 Unchecked 1
26986178 10.1021/acs.jmedchem.5b01909 Rattus norvegicus 1
26986178 10.1021/acs.jmedchem.5b01909 Glucagon receptor 1

Data from ChEMBL 36 via Core Engine