CHEMBL3759820
SMILES | CCCCCCCCCCCCCCCCNC(=O)CN(CC(=O)NC(C)(C)C(=O)N[C@@H](Cc1ccccc1)C(=O)N[C@@H](CC(C)C)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)C(=O)c1cccnc1 |
InChIKey | WLCCAYLWTHJGKL-NRNPVHEPSA-N |
Chemical properties
Hydrogen bond acceptors | 15 |
Hydrogen bond donors | 16 |
Rotatable bonds | 51 |
Molecular weight (Da) | 1475.9 |
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 |
NMU1 | NMUR1 | Human | Neuromedin U | A | pEC50 | 7.32 | 7.32 | 7.32 | ChEMBL |
NMU2 | NMUR2 | Human | Neuromedin U | A | pEC50 | 7.37 | 7.37 | 7.37 | ChEMBL |