CHEMBL4175829


SMILES CCc1nc2c(N3CCNCC3)ccnc2n1Cc1cccc(F)c1
InChIKey VVFMFUGAHRAYJX-UHFFFAOYSA-N

Chemical properties

Hydrogen bond acceptors 5
Hydrogen bond donors 1
Rotatable bonds 4
Molecular weight (Da) 339.2

Drug properties

Molecular type Small molecule
Physiological/Surrogate Surrogate
Approved drug No

Database connections

Bioactivities

Receptor Activity Source
GTP Uniprot Species Family Class Type Min Avg Max Database
5-HT7 5HT7R Human 5-Hydroxytryptamine A pKi 4.91 4.91 4.91 ChEMBL
5-HT6 5HT6R Human 5-Hydroxytryptamine A pKi 8.22 8.22 8.22 ChEMBL
5-HT2A 5HT2A Human 5-Hydroxytryptamine A pKi 6.36 6.36 6.36 ChEMBL
5-HT1A 5HT1A Human 5-Hydroxytryptamine A pKi 5.55 5.55 5.55 ChEMBL
D2 DRD2 Human Dopamine A pKi 5.46 5.46 5.46 ChEMBL
Receptor Activity Source
GTP Uniprot Species Family Class Type Min Avg Max Database
5-HT6 5HT6R Human 5-Hydroxytryptamine A pIC50 7.75 7.75 7.75 ChEMBL