CAS Registry No. - 486460-32-6
ChEBI - CHEBI:40237
ChEMBL Ligand - CHEMBL1422
DrugBank Ligand - DB07214
PubChem CID - 4369359
Wikipedia - Sitagliptin
RCSB PDB Ligand - 715
PEP - sitagliptin
DrugCentral Ligand - 2448
sitagliptin
Structure
Molecular Details
| Molecular mass (Da) | 407.11807 |
| Hydrogen bond acceptors | 6 |
| Hydrogen bond donors | 1 |
| Polar surface area (A2) | 77.04 |
| Lipinski rules broken | 0 |
| logP | 2.805 |
Other Details
| Ligand type | Synthetic organic |
| Radiolabelled | No |
| Approved | Yes |
| Approval Source | FDA (2006) |
Responsive Sequences