CHEMBL3759408
SMILES | CC(C)C[C@H](NC(=O)[C@H](Cc1ccccc1)NC(=O)CCCCCNC(=O)[C@@H](N)CS)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(=O)NCCCCCC(=O)N[C@@H](CS)C(N)=O |
InChIKey | FNLRHCKDWBNOEN-IAUAMBRNSA-N |
Chemical properties
Hydrogen bond acceptors | 17 |
Hydrogen bond donors | 20 |
Rotatable bonds | 46 |
Molecular weight (Da) | 1379.7 |
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 | 6.79 | 6.79 | 6.79 | ChEMBL |
NMU2 | NMUR2 | Human | Neuromedin U | A | pEC50 | 6.55 | 6.55 | 6.55 | ChEMBL |