brucine N-oxide


SMILES COc1cc2c(cc1OC)N1[C@@H]3[C@@]42CC[N@@+]2([C@H]4C[C@@H]4[C@H]3[C@H](CC1=O)OCC=C4C2)[O-]
InChIKey HHHQMKWPZAYIAE-WAIXHZNCSA-N

Chemical properties

Hydrogen bond acceptors 5
Hydrogen bond donors 0
Rotatable bonds 2
Molecular weight (Da) 410.2

Drug properties

Molecular type Small molecule
Endogenous/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 3.2 3.2 3.2 Guide to Pharmacology
M2 ACM2 Human Acetylcholine (muscarinic) A pKd 3.5 3.5 3.5 Guide to Pharmacology
M3 ACM3 Human Acetylcholine (muscarinic) A pKd 2.5 2.5 2.5 Guide to Pharmacology
M4 ACM4 Human Acetylcholine (muscarinic) A pKd 3.6 3.6 3.6 Guide to Pharmacology
M5 ACM5 Human Acetylcholine (muscarinic) A pKd 2.3 2.3 2.3 Guide to Pharmacology
Receptor Activity Source
GTP Uniprot Species Family Class Type Min Avg Max Database