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Compound Detail

CHEMBL384341

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CCNC(=O)[C@H]1CCCN1C(=O)[C@H](CCCN=C(N)N)NC(=O)[C@H](CC(C)C)NC(=O)[C@@H](Cc1c[nH]c2ccccc12)NC(=O)[C@H](Cc1ccc(O)cc1)NC(=O)[C@H](CO)NC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)CCc1ccc(F)cc1F

Basic Information

ChEMBL ID CHEMBL384341
Phase Preclinical
Structure Type MOL
InChI Key XGVHLIGBSLLBFW-BIOHGXQXSA-N
1
Targets
2
Activities
2
Assay Types
0
PK Parameters
2
Publications
0
Known Names

Molecular Properties

1202.4
MW (Da)

Drug Information

Molecule Type Small molecule
Availability Unknown
Chirality Unknown

Flags

First in Class Prodrug

Extended Properties

Molecular Formula C62H77F2N13O10
MW 1202.37

Activity Summary

Kd 1 meas. best 10.85
Ki 1 meas.

Target Activity Profile

Target Type Best pChEMBL Mean pChEMBL Best (nM) # Data
Rattus norvegicus
CHEMBL376
Kd 10.85 10.85 0.0 1

Activity Data Samples

Top measurements by pChEMBL value

Target Type Rel. Value Units pChEMBL Assay PubMed
Rattus norvegicus Kd = 0.01413 nM 10.85 In vitro antagonistic potency against release of luteinizing hormone (LH) from c... 7510341

Literature References

PubMed DOI Target Context # Activities
7510341 10.1021/jm00031a021 Gonadotropin-releasing hormone receptor 1
7510341 10.1021/jm00031a021 Rattus norvegicus 1

Data from ChEMBL 36 via Core Engine