CHEMBL3770106


SMILES CCOC(=O)c1cccc(NC2=NC(N)=NC3(CCCCC3)N2)c1
InChIKey IQDAWMWSGXPSNV-UHFFFAOYSA-N

Chemical properties

Hydrogen bond acceptors 7
Hydrogen bond donors 3
Rotatable bonds 3
Molecular weight (Da) 329.2

Drug properties

Molecular type Small molecule
Physiological/Surrogate Surrogate
Approved drug No

Database connections

Sankey plot

Compound is not listed as a drug.

Bioactivities

Receptor Activity Source
GTP Uniprot Species Family Class Type Min Avg Max Database
5-HT5A 5HT5A Human 5-Hydroxytryptamine A pKi 6.34 6.34 6.34 ChEMBL
5-HT1D 5HT1D Human 5-Hydroxytryptamine A pKi 5.07 5.07 5.07 ChEMBL
5-HT7 5HT7R Human 5-Hydroxytryptamine A pKi 6.33 6.33 6.33 ChEMBL
5-HT6 5HT6R Human 5-Hydroxytryptamine A pKi 5.45 5.45 5.45 ChEMBL
5-HT2B 5HT2B Human 5-Hydroxytryptamine A pKi 8.14 8.14 8.14 ChEMBL
5-HT2C 5HT2C Human 5-Hydroxytryptamine A pKi 6.07 6.07 6.07 ChEMBL
5-HT2A 5HT2A Human 5-Hydroxytryptamine A pKi 6.76 6.76 6.76 ChEMBL
5-HT1A 5HT1A Human 5-Hydroxytryptamine A pKi 6.15 6.15 6.15 ChEMBL
Receptor Activity Source
GTP Uniprot Species Family Class Type Min Avg Max Database
5-HT2B 5HT2B Human 5-Hydroxytryptamine A pIC50 7.56 7.56 7.56 ChEMBL