GPCRdb

UNC0006

Agent/drug
Bioactivity

UNC0006

SMILES	O=C1CCc2ccc(OCCCCN3CCCN(c4cccc(Cl)c4Cl)CC3)cc2N1
InChIKey	NGCKUAWDNUFNBB-UHFFFAOYSA-N

Chemical Properties

Hydrogen bond acceptors	4
Hydrogen bond donors	1
Rotatable bonds	7
Molecular weight (Da)	461.2

Database connections

PubChem Guide To Pharmacology ChEMBL_compound_ids GPCRdb

Bioactivities

Affinity
Potency

Search:

Receptor					Activity				Source

Protein	Gene	Species	Family	Class	Type	Min	Avg	Max	Database

5-HT_1A	5HT1A	Human	5-Hydroxytryptamine	A	pKi	7.22	8.22	9.22	ChEMBL
5-HT_2A	5HT2A	Human	5-Hydroxytryptamine	A	pKi	7.80	8.57	9.22	ChEMBL
5-HT_2B	5HT2B	Human	5-Hydroxytryptamine	A	pKi	9.22	9.22	9.22	ChEMBL
5-HT_2C	5HT2C	Human	5-Hydroxytryptamine	A	pKi	6.94	8.08	9.22	ChEMBL
D₁	DRD1	Human	Dopamine	A	pKi	6.08	6.28	6.47	ChEMBL
D₂	DRD2	Human	Dopamine	A	pKi	8.30	8.30	8.30	Guide to Pharmacology
D₂	DRD2	Human	Dopamine	A	pKi	8.30	8.83	9.70	ChEMBL
D₃	DRD3	Human	Dopamine	A	pKi	7.80	8.26	8.72	ChEMBL
D₄	DRD4	Human	Dopamine	A	pKi	6.70	6.91	7.12	ChEMBL
D₅	DRD5	Human	Dopamine	A	pKi	5.96	6.08	6.21	ChEMBL

Showing 1 to 10 of 10 entries

Search:

Receptor					Activity				Source

Protein	Gene	Species	Family	Class	Type	Min	Avg	Max	Database

5-HT_1A	5HT1A	Human	5-Hydroxytryptamine	A	pEC50	5.60	5.60	5.60	ChEMBL
D₂	DRD2	Human	Dopamine	A	pEC50	8.92	8.92	8.92	Guide to Pharmacology
D₂	DRD2	Human	Dopamine	A	pEC50	6.57	7.66	8.70	ChEMBL

Showing 1 to 3 of 3 entries

UNC0006

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

PubChem Guide To Pharmacology ChEMBL_compound_ids GPCRdb

Compound is not listed as a drug.