GPCRdb

TRIOXSALEN

Agent/drug
Bioactivity

TRIOXSALEN

SMILES	Cc1cc2cc3c(C)cc(=O)oc3c(C)c2o1
InChIKey	FMHHVULEAZTJMA-UHFFFAOYSA-N

Chemical Properties

Hydrogen bond acceptors	3
Hydrogen bond donors	0
Rotatable bonds	0
Molecular weight (Da)	228.1

Database connections

ChEMBL_compound_ids PubChem GPCRdb

Bioactivities

Affinity
Potency

Search:

Receptor					Activity				Source

Protein	Gene	Species	Family	Class	Type	Min	Avg	Max	Database

5-HT_2C	5HT2C	Human	5-Hydroxytryptamine	A	pKi	5.91	5.91	5.91	ChEMBL
5-HT_2C	5HT2C	Human	5-Hydroxytryptamine	A	pKi	8.23	8.23	8.23	Drug Central
A_2A	AA2AR	Human	Adenosine	A	pKi	6.13	6.13	6.13	ChEMBL
A_2A	AA2AR	Human	Adenosine	A	pKi	8.21	8.21	8.21	Drug Central

Showing 1 to 4 of 4 entries

Search:

Receptor					Activity				Source

Protein	Gene	Species	Family	Class	Type	Min	Avg	Max	Database

5-HT_2C	5HT2C	Human	5-Hydroxytryptamine	A	pIC50	5.63	5.63	5.63	ChEMBL
A_2A	AA2AR	Human	Adenosine	A	pIC50	5.88	5.88	5.88	ChEMBL

Showing 1 to 2 of 2 entries

TRIOXSALEN

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 0

Database connections

ChEMBL_compound_ids PubChem GPCRdb

Compound is not listed as a drug.