CHEMBL3805693
SMILES | O=C(O)c1csc([C@H]2CC[C@H]3[C@H](C[C@@H](O)[C@@H]3/C=C/COc3ccccc3)O2)n1 |
InChIKey | YMDRBQRLLNYQNG-NRUVFZJOSA-N |
Chemical properties
Hydrogen bond acceptors | 6 |
Hydrogen bond donors | 2 |
Rotatable bonds | 6 |
Molecular weight (Da) | 401.1 |
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 |
Receptor | Activity | Source | |||||||
---|---|---|---|---|---|---|---|---|---|
GTP | Uniprot | Species | Family | Class | Type | Min | Avg | Max | Database |
EP1 | PE2R1 | Human | Prostanoid | A | pEC50 | 6.16 | 6.16 | 6.16 | ChEMBL |
EP2 | PE2R2 | Human | Prostanoid | A | pEC50 | 8.42 | 8.42 | 8.42 | ChEMBL |
EP3 | PE2R3 | Human | Prostanoid | A | pEC50 | 5.12 | 5.12 | 5.12 | ChEMBL |