CHEMBL4858915
SMILES | CC(C)C[C@H](NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@@H]1CCC(=O)N[C@@H](CCCNC(=N)N)C(=O)NCC(=O)N[C@@H](Cc2ccc(O)cc2)C(=O)N1)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](Cc1ccc(O)cc1)C(N)=O |
InChIKey | RFHHXSZNNSMYFH-PEAOEFARSA-N |
Chemical properties
Hydrogen bond acceptors | 14 |
Hydrogen bond donors | 20 |
Rotatable bonds | 27 |
Molecular weight (Da) | 1092.6 |
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 |
Y4 | NPY4R | Human | Neuropeptide Y | A | pKi | 8.6 | 8.6 | 8.6 | ChEMBL |
Y1 | NPY1R | Human | Neuropeptide Y | A | pKi | 6.12 | 6.23 | 6.34 | ChEMBL |
Receptor | Activity | Source | |||||||
---|---|---|---|---|---|---|---|---|---|
GTP | Uniprot | Species | Family | Class | Type | Min | Avg | Max | Database |
Y4 | NPY4R | Human | Neuropeptide Y | A | pEC50 | 6.17 | 6.5 | 6.75 | ChEMBL |