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Compound Detail

CHEMBL2369787

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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=C\c1ccc(OC)cc1

Basic Information

ChEMBL ID CHEMBL2369787
Phase Preclinical
Structure Type MOL
InChI Key HXFNFYNLVICVMK-KEYNBIDKSA-N
1
Targets
2
Activities
2
Assay Types
0
PK Parameters
1
Publications
0
Known Names

Molecular Properties

1008.2
MW (Da)

Drug Information

Molecule Type Unknown
Availability Unknown
Chirality Unknown

Flags

First in Class Prodrug

Extended Properties

Molecular Formula C52H69N11O10
MW 1008.19

Activity Summary

Kd 1 meas. best 7.22
Ki 1 meas. best 8.85

Target Activity Profile

Target Type Best pChEMBL Mean pChEMBL Best (nM) # Data
Lutropin-choriogonadotropic hormone receptor
CHEMBL2456
Ki 8.85 8.85 1.4 1
Lutropin-choriogonadotropic hormone receptor
CHEMBL2456
Kd 7.22 7.22 60.3 1

Activity Data Samples

Top measurements by pChEMBL value

Literature References

PubMed DOI Target Context # Activities
2552116 10.1021/jm00130a019 Lutropin-choriogonadotropic hormone receptor 2

Data from ChEMBL 36 via Core Engine