CHEMBL579318
SMILES | Cc1oc2c(c1C(=O)NCc1cccnc1)C(=O)c1ccccc1C2=O |
InChIKey | HSYUWLOZMGPYKC-UHFFFAOYSA-N |
Chemical properties
Hydrogen bond acceptors | 5 |
Hydrogen bond donors | 1 |
Rotatable bonds | 3 |
Molecular weight (Da) | 346.1 |
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 |
S1P4 | S1PR4 | Human | Lysophospholipid (S1P) | A | pIC50 | 6.24 | 6.24 | 6.24 | ChEMBL |
S1P1 | S1PR1 | Human | Lysophospholipid (S1P) | A | pIC50 | 5.44 | 5.44 | 5.44 | ChEMBL |
NPS | NPSR1 | Human | Neuropeptide S | A | Potency | 5.7 | 5.7 | 5.7 | ChEMBL |