CHEMBL3753221
SMILES | CCCCC1([C@H](O)/C=C/[C@H]2COC(=O)N2CCSc2nc(C(=O)O)cs2)CCC1 |
InChIKey | RIWSCZBTNQWOHL-HMRWBYCRSA-N |
Chemical properties
Hydrogen bond acceptors | 7 |
Hydrogen bond donors | 2 |
Rotatable bonds | 11 |
Molecular weight (Da) | 440.1 |
Drug properties
Molecular type | Small molecule |
Endogenous/Surrogate | Surrogate |
Approved drug | No |
Database connections
Bioactivities
Receptor | Activity | Source | |||||||
---|---|---|---|---|---|---|---|---|---|
GTP | Uniprot | Species | Family | Class | Type | Min | Avg | Max | Database |
EP1 | PE2R1 | Human | Prostanoid | A | pKi | 6.66 | 6.66 | 6.66 | ChEMBL |
Receptor | Activity | Source | |||||||
---|---|---|---|---|---|---|---|---|---|
GTP | Uniprot | Species | Family | Class | Type | Min | Avg | Max | Database |
EP2 | PE2R2 | Human | Prostanoid | A | pEC50 | 8.54 | 8.54 | 8.54 | ChEMBL |
EP4 | PE2R4 | Human | Prostanoid | A | pEC50 | 7.14 | 7.14 | 7.14 | ChEMBL |
EP3 | PE2R3 | Human | Prostanoid | A | pEC50 | 8.41 | 8.41 | 8.41 | ChEMBL |