GPCRdb

CHEMBL4596734

Agent/drug
Bioactivity

CHEMBL4596734

SMILES	CCCNC1CN(c2ccnc(N)n2)C1
InChIKey	RUMWHMMFUXGDRP-UHFFFAOYSA-N

Chemical Properties

Hydrogen bond acceptors	5
Hydrogen bond donors	2
Rotatable bonds	4
Molecular weight (Da)	207.1

Database connections

ChEMBL_compound_ids ChEMBL_compound_ids PubChem GPCRdb

Bioactivities

Affinity
Potency

Search:

Receptor					Activity				Source

Protein	Gene	Species	Family	Class	Type	Min	Avg	Max	Database

H₃	HRH3	Mouse	Histamine	A	pKi	9.00	9.00	9.00	ChEMBL
H₃	HRH3	Human	Histamine	A	pKi	8.50	8.50	8.50	ChEMBL
H₄	HRH4	Mouse	Histamine	A	pKi	7.80	7.80	7.80	ChEMBL
H₄	HRH4	Human	Histamine	A	pKi	8.10	8.10	8.10	ChEMBL

Showing 1 to 4 of 4 entries

Search:

Receptor					Activity				Source

Protein	Gene	Species	Family	Class	Type	Min	Avg	Max	Database

H₃	HRH3	Mouse	Histamine	A	pEC50	10.00	10.00	10.00	ChEMBL
H₃	HRH3	Human	Histamine	A	pEC50	8.40	8.95	9.50	ChEMBL
H₄	HRH4	Mouse	Histamine	A	pEC50	9.00	9.00	9.00	ChEMBL
H₄	HRH4	Human	Histamine	A	pEC50	8.50	8.50	8.50	ChEMBL

Showing 1 to 4 of 4 entries

CHEMBL4596734

Drug properties

Molecular type	Small molecule
Physiological/Surrogate	Surrogate
Approved drug	No

Distribution across phases (no. indications)

Phase I 0

Phase II 0

Phase III 0

Phase IV

Database connections

ChEMBL_compound_ids ChEMBL_compound_ids PubChem GPCRdb

Compound is not listed as a drug.