CHEMBL224623
SMILES | CCCCCCCCCc1ccc(CN2CC(C(=O)O)C2)cc1 |
InChIKey | OVHZTRSKNATTNM-UHFFFAOYSA-N |
Chemical properties
Hydrogen bond acceptors | 2 |
Hydrogen bond donors | 1 |
Rotatable bonds | 11 |
Molecular weight (Da) | 317.2 |
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 |
S1P1 | S1PR1 | Human | Lysophospholipid (S1P) | A | pIC50 | 7.75 | 7.75 | 7.75 | ChEMBL |
S1P3 | S1PR3 | Human | Lysophospholipid (S1P) | A | pIC50 | 5.31 | 5.31 | 5.31 | ChEMBL |
S1P4 | S1PR4 | Human | Lysophospholipid (S1P) | A | pIC50 | 5.27 | 5.27 | 5.27 | ChEMBL |
S1P5 | S1PR5 | Human | Lysophospholipid (S1P) | A | pIC50 | 7.96 | 7.96 | 7.96 | ChEMBL |