CHEMBL121964
SMILES | Oc1cc2c(cc1O)C(Cc1cc(I)c(O)c(I)c1)NCC2 |
InChIKey | GVFDUZTYRLNDSS-UHFFFAOYSA-N |
Chemical properties
Hydrogen bond acceptors | 4 |
Hydrogen bond donors | 4 |
Rotatable bonds | 2 |
Molecular weight (Da) | 522.9 |
Drug properties
Molecular type | Small molecule |
Physiological/Surrogate | Surrogate |
Approved drug | No |
Database connections
Bioactivities
Receptor | Activity | Source | |||||||
---|---|---|---|---|---|---|---|---|---|
GTP | Uniprot | Species | Family | Class | Type | Min | Avg | Max | Database |
TP | TA2R | Human | Prostanoid | A | pKi | 4.72 | 4.72 | 4.72 | ChEMBL |
β2 | ADRB2 | Human | Adrenoceptors | A | pKi | 7.93 | 7.93 | 7.93 | ChEMBL |
Receptor | Activity | Source | |||||||
---|---|---|---|---|---|---|---|---|---|
GTP | Uniprot | Species | Family | Class | Type | Min | Avg | Max | Database |