[English] 日本語
Yorodumi- ChemComp-1LT: (2S)-N~1~-{4-methyl-5-[2-(1,1,1-trifluoro-2-methylpropan-2-yl)pyr... -
+Open data
-Basic information
Entry | Database: PDB chemical components / ID: 1LT | ||||
---|---|---|---|---|---|
Name | Name: ( Synonyms: Alpelisib Wikipedia | Wikipedia - Alpelisib: |
Alpelisib, sold under the brand name Piqray among others, is a medication used to treat certain types of breast cancer. It is used together with fulvestrant... Comment | medication*YM | |
-Chemical information
Composition | Formula: C19H22F3N5O2S / Number of atoms: 52 / Formula weight: 441.47 / Formal charge: 0 | ||||||
---|---|---|---|---|---|---|---|
Others | Type: NON-POLYMER / PDB classification: HETAIN / Three letter code: 1LT / Ideal coordinates details: Corina / Model coordinates PDB-ID: 4JPS | ||||||
History |
| ||||||
External links | UniChem / BindingDB / Brenda / ChEBI / ChEMBL / ChemicalBook / CompTox / DrugBank / GtoPharmacology / HMDB / Nikkaji / PubChem / PubChem_TPharma / SureChEMBL / ZINC / ChemSpider / Wikipedia search / Google search |
-Structure visualization
Structure viewer | Molecule: MolmilJmol/JSmol |
---|
-Details
-SMILES
ACDLabs 12.01 | CACTVS 3.370 | OpenEye OEToolkits 1.7.6 | |
---|
-SMILES CANONICAL
CACTVS 3.370 | OpenEye OEToolkits 1.7.6 | |
---|
-InChI
InChI 1.03 |
---|
-InChIKey
InChI 1.03 |
---|
-SYSTEMATIC NAME
ACDLabs 12.01 | (OpenEye OEToolkits 1.7.6 | ( | |
---|