CHEMBL4596899


SMILES CC(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)N[C@@H](C)C(=O)N[C@@H](Cc1ccc(O)cc1)C(=O)NCCCCC1CCN(CC(=O)N2c3ccccc3NC(=O)c3ccccc32)CC1
InChIKey XKYMIJTXUGXDLR-IKYRTNQJSA-N

Chemical properties

Hydrogen bond acceptors 8
Hydrogen bond donors 7
Rotatable bonds 17
Molecular weight (Da) 868.4

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
M5 ACM5 Human Acetylcholine (muscarinic) A pKi 6.9 6.91 6.92 ChEMBL
M4 ACM4 Human Acetylcholine (muscarinic) A pKi 7.4 7.42 7.43 ChEMBL
M3 ACM3 Human Acetylcholine (muscarinic) A pKi 5.9 5.92 5.94 ChEMBL
M2 ACM2 Human Acetylcholine (muscarinic) A pKi 7.7 7.7 7.7 ChEMBL
M1 ACM1 Human Acetylcholine (muscarinic) A pKi 7.0 7.02 7.03 ChEMBL
Receptor Activity Source
GTP Uniprot Species Family Class Type Min Avg Max Database