ALCURONIUM


SMILES C=CC[N@@+]12CC[C@@]34c5ccccc5N5/C=C6/[C@H]7C[C@H]8[C@@]9(CC[N@@+]8(CC=C)C/C7=C/CO)c7ccccc7N(/C=C(/[C@@H](C[C@@H]31)/C(=C\CO)C2)[C@H]54)[C@@H]69
InChIKey MUQUYTSLDVKIOF-CHJKCJHBSA-N

Chemical properties

Hydrogen bond acceptors 4
Hydrogen bond donors 2
Rotatable bonds 6
Molecular weight (Da) 666.4

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
M1 ACM1 Human Acetylcholine (muscarinic) A pKd 8.3 8.3 8.3 Drug Central
M2 ACM2 Human Acetylcholine (muscarinic) A pKd 8.16 8.16 8.16 Drug Central
M3 ACM3 Human Acetylcholine (muscarinic) A pKd 8.24 8.24 8.24 Drug Central
M4 ACM4 Human Acetylcholine (muscarinic) A pKi 8.25 8.25 8.25 Drug Central
Receptor Activity Source
GTP Uniprot Species Family Class Type Min Avg Max Database
M2 ACM2 Pig Acetylcholine (muscarinic) A pEC50 8.7 8.7 8.7 ChEMBL
M2 ACM2 Pig Acetylcholine (muscarinic) A pEC50 8.06 8.06 8.06 Drug Central