CHEMBL4064974


SMILES O=C(NCCCCN1CCN(c2ccccc2OCCF)CC1)c1cc2ccccn2n1
InChIKey ASYRWYXXPRLTPR-UHFFFAOYSA-N

Chemical properties

Hydrogen bond acceptors 6
Hydrogen bond donors 1
Rotatable bonds 10
Molecular weight (Da) 439.2

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
D5 DRD5 Human Dopamine A pKi 5.42 5.42 5.42 ChEMBL
D4 DRD4 Human Dopamine A pKi 6.8 6.8 6.8 ChEMBL
D1 DRD1 Human Dopamine A pKi 6.07 6.07 6.07 ChEMBL
D3 DRD3 Human Dopamine A pKi 9.51 9.51 9.51 ChEMBL
5-HT2A 5HT2A Human 5-Hydroxytryptamine A pKi 6.28 6.28 6.28 ChEMBL
D2 DRD2 Human Dopamine A pKi 7.41 7.54 7.68 ChEMBL
Receptor Activity Source
GTP Uniprot Species Family Class Type Min Avg Max Database