CHEMBL3893346
SMILES | COc1ccc(N(C(=O)OC[C@H]2CC[C@H](COCC(=O)O)CC2)c2ccccc2)cc1 |
InChIKey | JXNOKAGQNHMCNO-WGSAOQKQSA-N |
Chemical properties
Hydrogen bond acceptors | 5 |
Hydrogen bond donors | 1 |
Rotatable bonds | 9 |
Molecular weight (Da) | 427.2 |
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 |
Receptor | Activity | Source | |||||||
---|---|---|---|---|---|---|---|---|---|
GTP | Uniprot | Species | Family | Class | Type | Min | Avg | Max | Database |
IP | PI2R | Rat | Prostanoid | A | pEC50 | 6.78 | 6.78 | 6.78 | ChEMBL |
IP | PI2R | Human | Prostanoid | A | pEC50 | 8.48 | 8.53 | 8.57 | ChEMBL |
IP | PI2R | Human | Prostanoid | A | pIC50 | 7.66 | 7.66 | 7.66 | ChEMBL |
DP1 | PD2R | Human | Prostanoid | A | pEC50 | 6.62 | 6.62 | 6.62 | ChEMBL |