MT-II
| SMILES | CCCC[C@@H](C(=O)N[C@H]1CC(=O)NCCCC[C@H](NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@H](NC(=O)[C@@H](NC1=O)Cc1[nH]cnc1)Cc1ccccc1)CCCN=C(N)N)Cc1c[nH]c2c1cccc2)C(=O)N)NC(=O)C |
| InChIKey | JDKLPDJLXHXHNV-MFVUMRCOSA-N |
| Sequence | XDHFRWK |
Chemical properties
| Hydrogen bond acceptors | 11 |
| Hydrogen bond donors | 13 |
| Rotatable bonds | 17 |
| Molecular weight (Da) | 1023.5 |
Drug properties
| Molecular type | Peptide |
| Physiological/Surrogate | Surrogate |
| Approved drug | No |
Database connections
Bioactivities
| Receptor | Activity | Source | |||||||
|---|---|---|---|---|---|---|---|---|---|
| GTP | Uniprot | Species | Family | Class | Type | Min | Avg | Max | Database |
| MC3 | MC3R | Human | Melanocortin | A | pKi | 8.3 | 8.3 | 8.3 | Guide to Pharmacology |
| MC4 | MC4R | Human | Melanocortin | A | pKi | 8.2 | 8.5 | 8.8 | Guide to Pharmacology |
| MC1 | MSHR | Human | Melanocortin | A | pKi | 9.88 | 9.93 | 10.0 | ChEMBL |
| MC5 | MC5R | Human | Melanocortin | A | pKi | 7.4 | 7.4 | 7.4 | ChEMBL |
| MC3 | MC3R | Human | Melanocortin | A | pKi | 7.73 | 8.18 | 9.03 | ChEMBL |
| MC4 | MC4R | Human | Melanocortin | A | pKi | 8.9 | 9.31 | 10.47 | ChEMBL |
| Receptor | Activity | Source | |||||||
|---|---|---|---|---|---|---|---|---|---|
| GTP | Uniprot | Species | Family | Class | Type | Min | Avg | Max | Database |
| MC1 | MSHR | Human | Melanocortin | A | pIC50 | 9.4 | 9.4 | 9.4 | Guide to Pharmacology |
| MC5 | MC5R | Human | Melanocortin | A | pIC50 | 9.0 | 9.0 | 9.0 | Guide to Pharmacology |
| MC5 | MC5R | Mouse | Melanocortin | A | pEC50 | 9.24 | 9.78 | 10.17 | ChEMBL |
| MC1 | MSHR | Mouse | Melanocortin | A | pEC50 | 9.66 | 10.43 | 10.7 | ChEMBL |
| MC4 | MC4R | Mouse | Melanocortin | A | pEC50 | 9.82 | 10.12 | 10.4 | ChEMBL |
| MC1 | MSHR | Human | Melanocortin | A | pIC50 | 8.17 | 9.22 | 10.0 | ChEMBL |
| MC1 | MSHR | Human | Melanocortin | A | pEC50 | 6.96 | 9.23 | 10.2 | ChEMBL |
| MC5 | MC5R | Human | Melanocortin | A | pIC50 | 7.36 | 8.07 | 8.82 | ChEMBL |
| MC5 | MC5R | Human | Melanocortin | A | pEC50 | 7.47 | 8.3 | 8.83 | ChEMBL |
| MC3 | MC3R | Human | Melanocortin | A | pEC50 | 7.47 | 8.75 | 10.21 | ChEMBL |
| MC3 | MC3R | Human | Melanocortin | A | pIC50 | 8.01 | 8.63 | 8.92 | ChEMBL |
| MC4 | MC4R | Human | Melanocortin | A | pIC50 | 8.13 | 8.8 | 9.14 | ChEMBL |
| MC4 | MC4R | Human | Melanocortin | A | pEC50 | 8.0 | 8.89 | 10.4 | ChEMBL |