CHEMBL3912801


SMILES CC(=O)NC1CCC(c2nnc(SCCCN3CC[C@]4(C[C@@H]4c4ccc(C(F)(F)F)cc4)C3)n2C)CC1
InChIKey QDBPUGDJXGIOJW-HFYIJGDASA-N

Chemical properties

Hydrogen bond acceptors 6
Hydrogen bond donors 1
Rotatable bonds 8
Molecular weight (Da) 535.3

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
M3 ACM3 Human Acetylcholine (muscarinic) A pKi 6.64 6.64 6.64 ChEMBL
M1 ACM1 Human Acetylcholine (muscarinic) A pKi 6.76 6.76 6.76 ChEMBL
D3 DRD3 Human Dopamine A pKi 8.56 8.56 8.56 ChEMBL
D2 DRD2 Human Dopamine A pKi 6.34 6.34 6.34 ChEMBL
Receptor Activity Source
GTP Uniprot Species Family Class Type Min Avg Max Database