CHEMBL5285607


SMILES CN(C)c1ccc2c(-c3ccc(-c4cn(CCCCCn5cc(CCCCCCN6CCC(COC(=O)Nc7ccc(F)cc7-c7ccc(F)c(Cl)c7)CC6)nn5)nn4)cc3C(=O)[O-])c3ccc(=[N+](C)C)cc-3oc2c1
InChIKey IPPGGAXXAKWHHQ-UHFFFAOYSA-N

Chemical properties

Hydrogen bond acceptors 13
Hydrogen bond donors 1
Rotatable bonds 21
Molecular weight (Da) 1052.5

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 8.13 8.13 8.13 ChEMBL
M4 ACM4 Human Acetylcholine (muscarinic) A pKi 8.85 8.85 8.85 ChEMBL
M3 ACM3 Human Acetylcholine (muscarinic) A pKi 8.64 9.18 9.88 ChEMBL
M3 ACM3 Human Acetylcholine (muscarinic) A pKd 7.62 7.63 7.64 ChEMBL
M2 ACM2 Human Acetylcholine (muscarinic) A pKi 7.96 7.96 7.96 ChEMBL
M1 ACM1 Human Acetylcholine (muscarinic) A pKd 8.08 8.11 8.14 ChEMBL
M1 ACM1 Human Acetylcholine (muscarinic) A pKi 8.82 8.82 8.82 ChEMBL
Receptor Activity Source
GTP Uniprot Species Family Class Type Min Avg Max Database
M3 ACM3 Human Acetylcholine (muscarinic) A pIC50 6.37 6.63 6.89 ChEMBL