GPCRdb

BENZOTHIAZYL DISULFIDE

Agent/drug
Bioactivity

BENZOTHIAZYL DISULFIDE

SMILES	c1ccc2sc(SSc3nc4ccccc4s3)nc2c1
InChIKey	AFZSMODLJJCVPP-UHFFFAOYSA-N

Chemical Properties

Hydrogen bond acceptors	6
Hydrogen bond donors	0
Rotatable bonds	3
Molecular weight (Da)	332.0

Database connections

ChEMBL_compound_ids PubChem GPCRdb

Bioactivities

Affinity
Potency

Search:

Receptor					Activity				Source

Protein	Gene	Species	Family	Class	Type	Min	Avg	Max	Database

α_2A	ADA2A	Human	Adrenoceptors	A	pKi	6.47	6.47	6.47	ChEMBL
α_2B	ADA2B	Human	Adrenoceptors	A	pKi	7.13	7.13	7.13	ChEMBL
α_2C	ADA2C	Human	Adrenoceptors	A	pKi	6.62	6.62	6.62	ChEMBL
κ	OPRK	Human	Opioid	A	pKi	6.30	6.30	6.30	ChEMBL
μ	OPRM	Human	Opioid	A	pKi	5.90	5.90	5.90	ChEMBL
5-HT_1A	5HT1A	Rat	5-Hydroxytryptamine	A	pKi	6.37	6.37	6.37	ChEMBL
5-HT₆	5HT6R	Human	5-Hydroxytryptamine	A	pKi	5.61	5.61	5.61	ChEMBL
A₃	AA3R	Human	Adenosine	A	pKi	6.71	6.71	6.71	ChEMBL
CCR2	CCR2	Human	Chemokine	A	pKi	6.03	6.03	6.03	ChEMBL
D₁	DRD1	Human	Dopamine	A	pKi	6.22	6.22	6.22	ChEMBL
D₂	DRD2	Human	Dopamine	A	pKi	5.71	5.71	5.71	ChEMBL
D₃	DRD3	Human	Dopamine	A	pKi	6.54	6.54	6.54	ChEMBL
MC₅	MC5R	Human	Melanocortin	A	pKi	5.43	5.43	5.43	ChEMBL

Showing 1 to 13 of 13 entries

Search:

Receptor					Activity				Source

Protein	Gene	Species	Family	Class	Type	Min	Avg	Max	Database

α_2A	ADA2A	Human	Adrenoceptors	A	pIC50	6.05	6.05	6.05	ChEMBL
α_2B	ADA2B	Human	Adrenoceptors	A	pIC50	6.79	6.79	6.79	ChEMBL
α_2C	ADA2C	Human	Adrenoceptors	A	pIC50	5.78	5.78	5.78	ChEMBL
κ	OPRK	Human	Opioid	A	pIC50	5.91	5.91	5.91	ChEMBL
μ	OPRM	Human	Opioid	A	pIC50	5.51	5.51	5.51	ChEMBL
5-HT_1A	5HT1A	Rat	5-Hydroxytryptamine	A	pIC50	6.13	6.13	6.13	ChEMBL
5-HT₆	5HT6R	Human	5-Hydroxytryptamine	A	pIC50	5.28	5.28	5.28	ChEMBL
A₃	AA3R	Human	Adenosine	A	pIC50	6.46	6.46	6.46	ChEMBL
CCR2	CCR2	Human	Chemokine	A	pIC50	5.62	5.62	5.62	ChEMBL
D₁	DRD1	Human	Dopamine	A	pIC50	5.92	5.92	5.92	ChEMBL
D₂	DRD2	Human	Dopamine	A	pIC50	5.23	5.23	5.23	ChEMBL
D₃	DRD3	Human	Dopamine	A	pIC50	6.07	6.07	6.07	ChEMBL
MC₅	MC5R	Human	Melanocortin	A	pIC50	5.41	5.41	5.41	ChEMBL

Showing 1 to 13 of 13 entries

BENZOTHIAZYL DISULFIDE

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 PubChem GPCRdb

Compound is not listed as a drug.