3,5-dimethyl PPP
SMILES | CCCOC(=O)c1[nH]c(c(c1C)C(=O)OC(C(C)(C)C)C)C |
InChIKey | DOYZAIRDDZPMQZ-UHFFFAOYSA-N |
Chemical properties
Hydrogen bond acceptors | 4 |
Hydrogen bond donors | 1 |
Rotatable bonds | 5 |
Molecular weight (Da) | 309.2 |
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 |
TAS2R14 | T2R14 | Human | Taste 2 | T | pEC50 | 4.4 | 4.4 | 4.4 | ChEMBL |
TAS2R8 | TA2R8 | Human | Taste 2 | T | pIC50 | 7.46 | 7.56 | 7.7 | ChEMBL |
TAS2R8 | TA2R8 | Human | Taste 2 | T | pIC50 | 7.7 | 7.7 | 7.7 | Guide to Pharmacology |