CHEMBL2385904
SMILES | CCc1ccc(-c2ccc(C(=O)N3CCc4c(c5ccccc5n4CC(=O)O)C3)cc2)cc1 |
InChIKey | PJEVQOJEJXZQAR-UHFFFAOYSA-N |
Chemical properties
Hydrogen bond acceptors | 3 |
Hydrogen bond donors | 1 |
Rotatable bonds | 5 |
Molecular weight (Da) | 438.2 |
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 |
DP1 | PD2R | Human | Prostanoid | A | pIC50 | 6.11 | 6.11 | 6.11 | ChEMBL |
EP2 | PE2R2 | Human | Prostanoid | A | pIC50 | 5.19 | 5.19 | 5.19 | ChEMBL |
DP2 | PD2R2 | Human | Prostanoid | A | pIC50 | 6.5 | 7.28 | 8.4 | ChEMBL |