CHEMBL4596065


SMILES CC(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CCCNC(=N)N)C(=O)NCCCCC1CCN(CC(=O)N2c3ccccc3NC(=O)c3ccccc32)CC1
InChIKey GLRXSDVYMJTKAU-CONSDPRKSA-N

Chemical properties

Hydrogen bond acceptors 8
Hydrogen bond donors 8
Rotatable bonds 19
Molecular weight (Da) 732.4

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 6.37 6.44 6.5 ChEMBL
M4 ACM4 Human Acetylcholine (muscarinic) A pKi 7.2 7.21 7.21 ChEMBL
M3 ACM3 Human Acetylcholine (muscarinic) A pKi 5.17 5.19 5.2 ChEMBL
M2 ACM2 Human Acetylcholine (muscarinic) A pKi 8.69 8.91 9.0 ChEMBL
M1 ACM1 Human Acetylcholine (muscarinic) A pKi 7.38 7.39 7.4 ChEMBL
Receptor Activity Source
GTP Uniprot Species Family Class Type Min Avg Max Database
M2 ACM2 Human Acetylcholine (muscarinic) A pIC50 7.03 7.63 8.48 ChEMBL