CHEMBL5028207


SMILES CC(=O)N[C@@H](CCCN)C(=O)NC(=O)[C@H](C)NC(=O)[C@H](CCCNC(=N)N)NCCN1CCN(C(=O)CCCC2CCN(CC(=O)N3c4ccccc4NC(=O)c4ccccc43)CC2)CC1
InChIKey NNQITYFIEKVWKV-LJDVJVEBSA-N

Chemical properties

Hydrogen bond acceptors 12
Hydrogen bond donors 9
Rotatable bonds 22
Molecular weight (Da) 915.5

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 5.58 5.58 5.58 ChEMBL
M4 ACM4 Human Acetylcholine (muscarinic) A pKi 6.14 6.14 6.15 ChEMBL
M2 ACM2 Human Acetylcholine (muscarinic) A pKi 7.34 7.53 7.71 ChEMBL
M1 ACM1 Human Acetylcholine (muscarinic) A pKi 6.59 6.72 6.85 ChEMBL
Receptor Activity Source
GTP Uniprot Species Family Class Type Min Avg Max Database