Compound Detail
CHEMBL385604
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CN(CC(=O)N[C@@H](CCCN=C(N)N)C(=O)NCC(N)=O)C(=O)[C@H]1CSSC2(CCCCC2)CC(=O)N[C@H](Cc2ccccc2)C(=O)N[C@@H](Cc2ccccc2)C(=O)N[C@@H](CCC(N)=O)C(=O)N[C@@H](CC(N)=O)C(=O)N1
Basic Information
| ChEMBL ID | CHEMBL385604 |
| Phase | Preclinical |
| Structure Type | MOL |
| InChI Key | OHEPVCIUSZALNG-ACXDWINASA-N |
1
Targets
2
Activities
1
Assay Types
0
PK Parameters
2
Publications
0
Known Names
Molecular Properties
1095.3
MW (Da)
Drug Information
| Molecule Type | Small molecule |
| Availability | Unknown |
| Chirality | Unknown |
Activity Summary
Kd 2 meas. best 8.59
Target Activity Profile
| Target | Type | Best pChEMBL | Mean pChEMBL | Best (nM) | # Data |
|---|---|---|---|---|---|
| Rattus norvegicus CHEMBL376 | Kd | 8.59 | 8.47 | 2.6 | 2 |
Activity Data Samples
Top measurements by pChEMBL value
| Target | Type | Rel. | Value | Units | pChEMBL | Assay | PubMed |
|---|---|---|---|---|---|---|---|
| Rattus norvegicus | Kd | = | 2.57 | nM | 8.59 | In vitro antiuterotonic activity in rat oxytocic bioassay in the absence of Mg2+ | 7507528 |
| Rattus norvegicus | Kd | = | 4.467 | nM | 8.35 | Inhibition of pressor response to exogenous AVP in the pitched rat preparation | 7507528 |
Literature References
| PubMed | DOI | Target Context | # Activities |
|---|---|---|---|
| 7507528 | 10.1021/jm00028a008 | Rattus norvegicus | 2 |
| 7507528 | 10.1021/jm00028a008 | Unchecked | 1 |
Data from ChEMBL 36 via Core Engine