CHEMBL4059733


SMILES CCC(=O)NCCNC(=O)CCc1cn(CCCCC2CCN(CC(=O)N3c4ccccc4NC(=O)c4ccccc43)CC2)cn1
InChIKey SADFFAQSWHTWLL-UHFFFAOYSA-N

Chemical properties

Hydrogen bond acceptors 7
Hydrogen bond donors 3
Rotatable bonds 14
Molecular weight (Da) 627.4

Drug properties

Molecular type Small molecule
Physiological/Surrogate Surrogate
Approved drug No

Database connections

Sankey plot

Compound is not listed as a drug.

Bioactivities

Receptor Activity Source
GTP Uniprot Species Family Class Type Min Avg Max Database
M5 ACM5 Human Acetylcholine (muscarinic) A pKi 6.8 6.8 6.8 ChEMBL
M4 ACM4 Human Acetylcholine (muscarinic) A pKi 8.6 8.6 8.6 ChEMBL
M2 ACM2 Human Acetylcholine (muscarinic) A pKi 7.99 8.86 9.12 ChEMBL
M2 ACM2 Human Acetylcholine (muscarinic) A pKd 9.06 9.09 9.15 ChEMBL
M1 ACM1 Human Acetylcholine (muscarinic) A pKi 8.1 8.1 8.1 ChEMBL
M3 ACM3 Human Acetylcholine (muscarinic) A pKi 7.2 7.2 7.2 ChEMBL
Receptor Activity Source
GTP Uniprot Species Family Class Type Min Avg Max Database
M2 ACM2 Human Acetylcholine (muscarinic) A pIC50 5.68 6.5 7.47 ChEMBL