CHEMBL5028706


SMILES CC(=O)NC(=O)[C@H](CCCCN)NC(=O)[C@H](C)NC(=O)[C@H](CCCNC(=N)N)NCCN1CCN(C(=O)CC2CCN(CC(=O)N3c4ccccc4NC(=O)c4ccccc43)CC2)CC1
InChIKey AGEMLNFTTKRLBW-IRJOAOCJSA-N

Chemical properties

Hydrogen bond acceptors 12
Hydrogen bond donors 9
Rotatable bonds 21
Molecular weight (Da) 901.5

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 5.06 5.06 5.06 ChEMBL
M2 ACM2 Human Acetylcholine (muscarinic) A pKi 6.61 6.61 6.61 ChEMBL
M1 ACM1 Human Acetylcholine (muscarinic) A pKi 5.21 5.21 5.21 ChEMBL
M4 ACM4 Human Acetylcholine (muscarinic) A pKi 5.2 5.2 5.2 ChEMBL
Receptor Activity Source
GTP Uniprot Species Family Class Type Min Avg Max Database