CHEMBL4757669
SMILES | CCC(NC(=O)[C@H](Cc1ccc(O)c([N+](=O)[O-])c1)NC(=O)[C@H](CCCCN)NC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)[C@@H](N)CC(N)=O)C(N)=O |
InChIKey | LKQQKKQSOSJUFO-LAQPOOPWSA-N |
Chemical properties
Hydrogen bond acceptors | 12 |
Hydrogen bond donors | 12 |
Rotatable bonds | 25 |
Molecular weight (Da) | 924.4 |
Drug properties
Molecular type | Small molecule |
Physiological/Surrogate | Surrogate |
Approved drug | No |
Database connections
Bioactivities
Receptor | Activity | Source | |||||||
---|---|---|---|---|---|---|---|---|---|
GTP | Uniprot | Species | Family | Class | Type | Min | Avg | Max | Database |
Receptor | Activity | Source | |||||||
---|---|---|---|---|---|---|---|---|---|
GTP | Uniprot | Species | Family | Class | Type | Min | Avg | Max | Database |
UT | UR2R | Human | Urotensin | A | pEC50 | 8.46 | 8.46 | 8.46 | ChEMBL |
UT | UR2R | Human | Urotensin | A | pIC50 | 5.96 | 5.96 | 5.96 | ChEMBL |