CHEMBL4596064


SMILES CC(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)N[C@@H](C)C(=O)N[C@@H](Cc1ccc(O)cc1)C(=O)NCCN1CCN(CCCCC2CCN(CC(=O)N3c4ccccc4NC(=O)c4ccccc43)CC2)CC1
InChIKey QFRDMVXRTJXQSC-GBJCMELBSA-N

Chemical properties

Hydrogen bond acceptors 10
Hydrogen bond donors 7
Rotatable bonds 20
Molecular weight (Da) 980.5

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 7.51 7.51 7.51 ChEMBL
M4 ACM4 Human Acetylcholine (muscarinic) A pKi 8.79 8.79 8.79 ChEMBL
M3 ACM3 Human Acetylcholine (muscarinic) A pKi 7.45 7.45 7.45 ChEMBL
M2 ACM2 Human Acetylcholine (muscarinic) A pKi 10.1 10.1 10.1 ChEMBL
M1 ACM1 Human Acetylcholine (muscarinic) A pKi 8.64 8.64 8.64 ChEMBL
Receptor Activity Source
GTP Uniprot Species Family Class Type Min Avg Max Database