CHEMBL364560
SMILES | COc1ccc(CC(=O)NCC2(N3CCN(C(=O)[C@@H](Cc4ccc(Cl)cc4Cl)NC(=O)CCN)CC3)CCCCC2)cc1 |
InChIKey | SDXNKLFMLKIOBP-MUUNZHRXSA-N |
Chemical properties
Hydrogen bond acceptors | 6 |
Hydrogen bond donors | 3 |
Rotatable bonds | 12 |
Molecular weight (Da) | 631.3 |
Drug properties
Molecular type | Small molecule |
Endogenous/Surrogate | Surrogate |
Approved drug | No |
Database connections
Bioactivities
Receptor | Activity | Source | |||||||
---|---|---|---|---|---|---|---|---|---|
GTP | Uniprot | Species | Family | Class | Type | Min | Avg | Max | Database |
MC5 | MC5R | Human | Melanocortin | A | pKi | 6.27 | 6.27 | 6.27 | ChEMBL |
MC3 | MC3R | Human | Melanocortin | A | pKi | 5.96 | 5.96 | 5.96 | ChEMBL |
MC4 | MC4R | Human | Melanocortin | A | pKi | 8.38 | 8.44 | 8.55 | ChEMBL |
MC1 | MSHR | Human | Melanocortin | A | pKi | 5.24 | 5.24 | 5.24 | ChEMBL |
Receptor | Activity | Source | |||||||
---|---|---|---|---|---|---|---|---|---|
GTP | Uniprot | Species | Family | Class | Type | Min | Avg | Max | Database |