CHEMBL438822


SMILES O=C(NC[C@@H]1CCCNC1)[C@H]1CCCN1C(=O)[C@@H]1C[C@@H](O)CN1C(=O)CC(c1ccc(F)cc1)(c1ccc(F)cc1)c1ccc(F)cc1
InChIKey DKABYCZEFMBXSO-BMSWWXRLSA-N

Chemical properties

Hydrogen bond acceptors 5
Hydrogen bond donors 3
Rotatable bonds 9
Molecular weight (Da) 662.3

Drug properties

Molecular type Small molecule
Endogenous/Surrogate Surrogate
Approved drug No

Database connections

Bioactivities

Receptor Activity Source
GTP Uniprot Species Family Class Type Min Avg Max Database
M5 ACM5 Human Acetylcholine (muscarinic) A pKi 5.77 5.77 5.77 ChEMBL
M4 ACM4 Human Acetylcholine (muscarinic) A pKi 7.41 7.41 7.41 ChEMBL
M3 ACM3 Human Acetylcholine (muscarinic) A pKi 9.41 9.41 9.41 ChEMBL
M2 ACM2 Human Acetylcholine (muscarinic) A pKi 6.35 6.35 6.35 ChEMBL
M1 ACM1 Human Acetylcholine (muscarinic) A pKi 6.52 6.52 6.52 ChEMBL
Receptor Activity Source
GTP Uniprot Species Family Class Type Min Avg Max Database