CHEMBL4598362


SMILES CC(=O)N[C@@H](Cc1ccc(O)cc1)C(=O)N[C@@H](C)C(=O)N[C@@H](CCCCN)C(=O)NCCCCC1CCN(CC(=O)N2c3ccccc3NC(=O)c3ccccc32)CC1
InChIKey MVDUBVLGXGZDSV-HRSOTDIYSA-N

Chemical properties

Hydrogen bond acceptors 9
Hydrogen bond donors 7
Rotatable bonds 19
Molecular weight (Da) 810.4

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 6.68 6.68 6.68 ChEMBL
M4 ACM4 Human Acetylcholine (muscarinic) A pKi 7.24 7.24 7.24 ChEMBL
M3 ACM3 Human Acetylcholine (muscarinic) A pKi 5.3 5.3 5.3 ChEMBL
M2 ACM2 Human Acetylcholine (muscarinic) A pKi 8.03 8.03 8.03 ChEMBL
M1 ACM1 Human Acetylcholine (muscarinic) A pKi 6.75 6.75 6.75 ChEMBL
Receptor Activity Source
GTP Uniprot Species Family Class Type Min Avg Max Database