Ro 04-6790
SMILES | CNc1nc(NC)nc(c1)NS(=O)(=O)c1ccc(cc1)N |
InChIKey | JELFWSXQTXRMAJ-UHFFFAOYSA-N |
Chemical properties
Hydrogen bond acceptors | 7 |
Hydrogen bond donors | 4 |
Rotatable bonds | 5 |
Molecular weight (Da) | 308.1 |
Drug properties
Molecular type | Small molecule |
Endogenous/Surrogate | Surrogate |
Approved drug | No |
Database connections
Ligand site mutations | 5-HT6 |
Bioactivities
Receptor | Activity | Source | |||||||
---|---|---|---|---|---|---|---|---|---|
GTP | Uniprot | Species | Family | Class | Type | Min | Avg | Max | Database |
MC1 | MSHR | Human | Melanocortin | A | pKi | 8.6 | 8.6 | 8.6 | Guide to Pharmacology |
MC3 | MC3R | Human | Melanocortin | A | pKi | 7.06 | 7.06 | 7.06 | Guide to Pharmacology |
MC4 | MC4R | Human | Melanocortin | A | pKi | 6.16 | 6.16 | 6.16 | Guide to Pharmacology |
MC5 | MC5R | Human | Melanocortin | A | pKi | 5.0 | 5.0 | 5.0 | Guide to Pharmacology |
MC3 | MC3R | Human | Melanocortin | A | pKi | 8.15 | 8.15 | 8.15 | Drug Central |
MC4 | MC4R | Human | Melanocortin | A | pKi | 8.21 | 8.21 | 8.21 | Drug Central |
MC1 | MSHR | Human | Melanocortin | A | pKi | 8.07 | 8.07 | 8.07 | Drug Central |
MC2 | ACTHR | Mouse | Melanocortin | A | pKd | 8.01 | 8.01 | 8.01 | Drug Central |
Receptor | Activity | Source | |||||||
---|---|---|---|---|---|---|---|---|---|
GTP | Uniprot | Species | Family | Class | Type | Min | Avg | Max | Database |