CHEMBL4098010
SMILES | CC(C)[C@H](NC(=O)[C@H](Cc1ccccc1)NC(=O)[C@H](Cc1ccc(O)cc1)NC(=O)CCN)C(=O)N[C@@H](Cc1ccccc1)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N1CCC[C@H]1C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CC(N)=O)C(N)=O |
InChIKey | YTOWLROLAIKBEN-XDJIWRSTSA-N |
Chemical properties
Hydrogen bond acceptors | 14 |
Hydrogen bond donors | 17 |
Rotatable bonds | 34 |
Molecular weight (Da) | 1167.6 |
Drug properties
Molecular type | Small molecule |
Physiological/Surrogate | Surrogate |
Approved drug | No |
Database connections
Sankey plot
Compound is not listed as a drug.
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 |
NMU1 | NMUR1 | Mouse | Neuromedin U | A | pEC50 | 9.24 | 9.24 | 9.24 | ChEMBL |
NMU2 | NMUR2 | Mouse | Neuromedin U | A | pEC50 | 10.06 | 10.06 | 10.06 | ChEMBL |
NMU1 | NMUR1 | Human | Neuromedin U | A | pEC50 | 9.51 | 9.51 | 9.51 | ChEMBL |
NMU2 | NMUR2 | Human | Neuromedin U | A | pEC50 | 9.82 | 9.82 | 9.82 | ChEMBL |