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Yorodumi- ChemComp-SPP: (1-(5-METHANSULPHONAMIDO-1H-INDOL-2-YL-CARBONYL)4-[METHYLAMINO)PY... -
+Open data
-Basic information
Entry | Database: PDB chemical components / ID: SPP | ||||
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Name | Name: ( Synonyms: Delavirdine Wikipedia | Wikipedia - Delavirdine: Delavirdine (brand name Rescriptor) is a non-nucleoside reverse transcriptase inhibitor (NNRTI) marketed by ViiV Healthcare. It is used as part of highly active antiretroviral therapy (HAART) for the treatment of human immunodeficiency virus (HIV) type 1... | Comment | antiretroviral, inhibitor*YM | |
-Chemical information
Composition | Formula: C22H28N6O3S / Number of atoms: 60 / Formula weight: 456.561 / Formal charge: 0 | ||||||||
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Others | Type: NON-POLYMER / PDB classification: HETAD / Three letter code: SPP / Ideal coordinates details: Corina / Model coordinates PDB-ID: 1KLM | ||||||||
History |
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External links | UniChem / BindingDB / Brenda / ChEBI / ChEMBL / ChemicalBook / CompTox / DailyMed / DrugBank / HMDB / KEGG_Ligand / Nikkaji / PubChem / PubChem_TPharma / SureChEMBL / ZINC / ChemSpider / Wikipedia search / Google search |
-Structure visualization
Structure viewer | Molecule: MolmilJmol/JSmol |
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-Details
-SMILES
ACDLabs 12.01 | CACTVS 3.370 | OpenEye OEToolkits 1.7.6 | |
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-SMILES CANONICAL
CACTVS 3.370 | OpenEye OEToolkits 1.7.6 | |
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-InChI
InChI 1.03 |
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-InChIKey
InChI 1.03 |
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-SYSTEMATIC NAME
ACDLabs 12.01 | OpenEye OEToolkits 1.7.6 | |
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-PDB entries
Showing all 1 items
PDB-1klm:
HIV-1 REVERSE TRANSCRIPTASE COMPLEXED WITH BHAP U-90152