CHEMBL448870


SMILES CC(C)OC(=O)c1ccc(NC(=O)N[C@@H](Cc2ccc(O)cc2)C(=O)N[C@H]2CCC[N+](C)(Cc3cccc(O)c3)C2)cc1
InChIKey SIEQNGMENABBKP-NZFBJFDYSA-O

Chemical properties

Hydrogen bond acceptors 6
Hydrogen bond donors 5
Rotatable bonds 10
Molecular weight (Da) 589.3

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 pKd 7.8 9.2 9.9 ChEMBL
M3 ACM3 Human Acetylcholine (muscarinic) A pKi 7.5 7.5 7.5 ChEMBL
M2 ACM2 Human Acetylcholine (muscarinic) A pKi 8.5 8.5 8.5 ChEMBL
M2 ACM2 Human Acetylcholine (muscarinic) A pKd 9.0 9.0 9.0 ChEMBL
M1 ACM1 Human Acetylcholine (muscarinic) A pKd 7.8 8.85 9.9 ChEMBL
M1 ACM1 Human Acetylcholine (muscarinic) A pKi 9.5 9.5 9.5 ChEMBL
Receptor Activity Source
GTP Uniprot Species Family Class Type Min Avg Max Database