CHEMBL228049
SMILES | CCCCCCc1ccc(OC[C@H](N)CCP(=O)(O)O)cc1 |
InChIKey | WHPOXXOGXRRLNK-OAHLLOKOSA-N |
Chemical properties
Hydrogen bond acceptors | 3 |
Hydrogen bond donors | 3 |
Rotatable bonds | 11 |
Molecular weight (Da) | 329.2 |
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 |
S1P2 | S1PR2 | Human | Lysophospholipid (S1P) | A | pEC50 | 6.28 | 6.28 | 6.28 | ChEMBL |
S1P1 | S1PR1 | Human | Lysophospholipid (S1P) | A | pEC50 | 6.85 | 6.85 | 6.85 | ChEMBL |
S1P3 | S1PR3 | Human | Lysophospholipid (S1P) | A | pEC50 | 7.0 | 7.0 | 7.0 | ChEMBL |
S1P4 | S1PR4 | Human | Lysophospholipid (S1P) | A | pEC50 | 6.82 | 6.82 | 6.82 | ChEMBL |
S1P5 | S1PR5 | Human | Lysophospholipid (S1P) | A | pEC50 | 7.33 | 7.33 | 7.33 | ChEMBL |