GPCRdb

gallamine

SMILES	CC[N+](CCOc1c(OCC[N+](CC)(CC)CC)cccc1OCC[N+](CC)(CC)CC)(CC)CC
InChIKey	OZLPUNFFCJDMJD-UHFFFAOYSA-N

Chemical properties

Hydrogen bond acceptors	3
Hydrogen bond donors	0
Rotatable bonds	21
Molecular weight (Da)	510.5

Drug properties

Molecular type	Small molecule
Physiological/Surrogate	Surrogate
Approved drug	Yes

Database connections

PubChem Guide To Pharmacology ChEMBL_compound_ids DrugBank Drug Central PubChem PubChem GPCRdb
Ligand site mutations	M₁ M₂

Bioactivities

Affinity
Potency

Receptor					Activity				Source
GTP	Uniprot	Species	Family	Class	Type	Min	Avg	Max	Database
M₂	ACM2	Human	Acetylcholine (muscarinic)	A	pKi	5.8	6.7	7.6	Guide to Pharmacology
M₂	ACM2	Human	Acetylcholine (muscarinic)	A	pKd	5.9	6.1	6.3	Guide to Pharmacology
M₂	ACM2	Rat	Acetylcholine (muscarinic)	A	pKi	5.6	5.6	5.6	Guide to Pharmacology
M₂	ACM2	Human	Acetylcholine (muscarinic)	A	pKi	5.43	5.97	6.33	ChEMBL
M₁	ACM1	Human	Acetylcholine (muscarinic)	A	pKi	5.07	5.07	5.07	ChEMBL
M₂	ACM2	Human	Acetylcholine (muscarinic)	A	pKi	5.76	5.76	5.76	PDSP Ki database
M₂	ACM2	Rat	Acetylcholine (muscarinic)	A	pKi	5.58	5.58	5.58	PDSP Ki database
M₁	ACM1	Human	Acetylcholine (muscarinic)	A	pKi	8.29	8.29	8.29	Drug Central
M₂	ACM2	Human	Acetylcholine (muscarinic)	A	pKi	8.21	8.21	8.21	Drug Central
M₂	ACM2	Rat	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
M₁	ACM1	Rat	Acetylcholine (muscarinic)	A	Potency	4.6	4.67	4.75	ChEMBL
M₂	ACM2	Human	Acetylcholine (muscarinic)	A	pIC50	5.7	5.91	6.11	ChEMBL
M₂	ACM2	Pig	Acetylcholine (muscarinic)	A	pEC50	8.16	8.16	8.16	Drug Central
TSH	TSHR	Human	Glycoprotein hormone	A	Potency	5.2	5.2	5.2	ChEMBL
M₂	ACM2	Pig	Acetylcholine (muscarinic)	A	pEC50	6.88	6.88	6.89	ChEMBL