CHEMBL4595691


SMILES CC(=O)N[C@@H](Cc1ccc(O)cc1)C(=O)N[C@@H](C)C(=O)N[C@@H](CCCCN)C(=O)NCCN1CCN(CCCCC2CCN(CC(=O)N3c4ccccc4NC(=O)c4ccccc43)CC2)CC1
InChIKey PMNZXPJWRDBQSA-UYBHOETKSA-N

Chemical properties

Hydrogen bond acceptors 11
Hydrogen bond donors 7
Rotatable bonds 22
Molecular weight (Da) 922.5

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 7.53 7.53 7.53 ChEMBL
M4 ACM4 Human Acetylcholine (muscarinic) A pKi 8.49 8.49 8.49 ChEMBL
M3 ACM3 Human Acetylcholine (muscarinic) A pKi 7.55 7.55 7.55 ChEMBL
M2 ACM2 Human Acetylcholine (muscarinic) A pKi 9.94 9.94 9.94 ChEMBL
M1 ACM1 Human Acetylcholine (muscarinic) A pKi 8.63 8.63 8.63 ChEMBL
Receptor Activity Source
GTP Uniprot Species Family Class Type Min Avg Max Database