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
Physiological/Surrogate Surrogate
Approved drug No

Database connections

Ligand site mutations 5-HT6

Sankey plot

Compound is not listed as a drug.

Bioactivities

Receptor Activity Source
GTP Uniprot Species Family Class Type Min Avg Max Database
5-HT6 5HT6R Human 5-Hydroxytryptamine A pKi 7.3 7.6 7.9 Guide to Pharmacology
5-HT6 5HT6R Rat 5-Hydroxytryptamine A pKi 7.4 7.5 7.6 Guide to Pharmacology
5-HT6 5HT6R Human 5-Hydroxytryptamine A pKi 7.24 7.28 7.35 ChEMBL
5-HT6 5HT6R Human 5-Hydroxytryptamine A pKi 7.29 7.29 7.29 PDSP Ki database
5-HT6 5HT6R Rat 5-Hydroxytryptamine A pKi 7.54 7.54 7.54 PDSP Ki database
5-HT6 5HT6R Mouse 5-Hydroxytryptamine A pKi 5.0 5.0 5.0 PDSP Ki database
Receptor Activity Source
GTP Uniprot Species Family Class Type Min Avg Max Database
M1 ACM1 Rat Acetylcholine (muscarinic) A Potency 4.6 4.6 4.6 ChEMBL
5-HT6 5HT6R Human 5-Hydroxytryptamine A pIC50 7.58 7.58 7.58 ChEMBL
NPS NPSR1 Human Neuropeptide S A Potency 7.3 7.3 7.3 ChEMBL