SB269970
SMILES | CC1CCN(CC1)CC[C@H]1CCCN1S(=O)(=O)c1cccc(c1)O |
InChIKey | HWKROQUZSKPIKQ-MRXNPFEDSA-N |
Chemical properties
Hydrogen bond acceptors | 4 |
Hydrogen bond donors | 1 |
Rotatable bonds | 5 |
Molecular weight (Da) | 352.2 |
Drug properties
Molecular type | Small molecule |
Endogenous/Surrogate | Surrogate |
Approved drug | Yes |
Database connections
Ligand site mutations | 5-HT7 |
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 |
MC4 | MC4R | Human | Melanocortin | A | pIC50 | 8.1 | 8.1 | 8.1 | Guide to Pharmacology |
MC4 | MC4R | Rat | Melanocortin | A | pEC50 | 5.3 | 5.3 | 5.3 | ChEMBL |
MC4 | MC4R | Rat | Melanocortin | A | pIC50 | 5.52 | 5.52 | 5.52 | ChEMBL |
MC4 | MC4R | Mouse | Melanocortin | A | pIC50 | 5.52 | 5.52 | 5.52 | ChEMBL |
MC4 | MC4R | Mouse | Melanocortin | A | pEC50 | 5.22 | 5.22 | 5.22 | ChEMBL |
MC3 | MC3R | Human | Melanocortin | A | pIC50 | 6.03 | 6.03 | 6.03 | ChEMBL |
MC4 | MC4R | Human | Melanocortin | A | pEC50 | 4.96 | 5.71 | 7.96 | ChEMBL |
MC4 | MC4R | Human | Melanocortin | A | pIC50 | 5.1 | 6.12 | 8.1 | ChEMBL |
MC5 | MC5R | Human | Melanocortin | A | pIC50 | 6.03 | 6.03 | 6.03 | ChEMBL |
MC5 | MC5R | Human | Melanocortin | A | pEC50 | 6.07 | 6.07 | 6.07 | ChEMBL |