CHEMBL4060830
SMILES | CCCCCCCCCCCC(=O)NC[C@H]1CC[C@H](C(=O)N[C@@H](CCC(=O)NCCCOCCOCCOCCCNC(=O)COCC(=O)N[C@@H](Cc2ccc(O)cc2)C(=O)NC(C)(Cc2ccccc2)C(=O)N[C@@H](CC(C)C)C(=O)NC(CCCC)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N2CCC[C@H]2C(=O)N[C@@H](CCCNC(=N)NC)C(=O)N[C@@H](CC(N)=O)C(=O)O)C(=O)O)CC1 |
InChIKey | IQEKJQLLVILLTE-PPOGYWQOSA-N |
Chemical properties
Hydrogen bond acceptors | 22 |
Hydrogen bond donors | 21 |
Rotatable bonds | 70 |
Molecular weight (Da) | 1874.1 |
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 |
NMU2 | NMUR2 | Mouse | Neuromedin U | A | pEC50 | 8.0 | 8.0 | 8.0 | ChEMBL |
NMU2 | NMUR2 | Human | Neuromedin U | A | pEC50 | 8.74 | 8.74 | 8.74 | ChEMBL |