CHEMBL4597071


SMILES CC(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CCCNC(=N)N)C(=O)NCCN1CCN(CCCCC2CCN(CC(=O)N3c4ccccc4NC(=O)c4ccccc43)CC2)CC1
InChIKey LISJYMSYSGWFLD-BCRBLDSWSA-N

Chemical properties

Hydrogen bond acceptors 10
Hydrogen bond donors 8
Rotatable bonds 22
Molecular weight (Da) 844.5

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 6.95 6.95 6.95 ChEMBL
M2 ACM2 Human Acetylcholine (muscarinic) A pKi 10.2 10.2 10.2 ChEMBL
M1 ACM1 Human Acetylcholine (muscarinic) A pKi 8.91 8.91 8.91 ChEMBL
M3 ACM3 Human Acetylcholine (muscarinic) A pKi 7.31 7.31 7.31 ChEMBL
M4 ACM4 Human Acetylcholine (muscarinic) A pKi 8.69 8.69 8.69 ChEMBL
Receptor Activity Source
GTP Uniprot Species Family Class Type Min Avg Max Database