CHEMBL3764557


SMILES Cc1ncoc1-c1nnc(SCCCN2CCOC(c3ccc(C(F)(F)F)cc3)C2)n1C
InChIKey OEUUCWVHNBAMPM-UHFFFAOYSA-N

Chemical properties

Hydrogen bond acceptors 8
Hydrogen bond donors 0
Rotatable bonds 7
Molecular weight (Da) 467.2

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
D3 DRD3 Rat Dopamine A pKi 6.9 7.1 7.3 ChEMBL
M3 ACM3 Human Acetylcholine (muscarinic) A pKi 6.0 6.0 6.0 ChEMBL
M1 ACM1 Human Acetylcholine (muscarinic) A pKi 6.0 6.0 6.0 ChEMBL
D3 DRD3 Human Dopamine A pKi 7.6 7.6 7.6 ChEMBL
D2 DRD2 Human Dopamine A pKi 4.9 4.9 4.9 ChEMBL
Receptor Activity Source
GTP Uniprot Species Family Class Type Min Avg Max Database