+Open data
-Basic information
Entry | Database: PDB chemical components / ID: K1S | ||||
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Name | Name: Wikipedia | Wikipedia - Trapidil: Trapidil is a vasodilator and an antiplatelet drug. It also acts as an antagonist of platelet-derived growth factor. | An analog was assigned the codename AR 12-456. Comment | antagonist*YM | |
-Chemical information
Composition | Formula: C10H15N5 / Number of atoms: 30 / Formula weight: 205.26 / Formal charge: 0 | ||||
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Others | Type: NON-POLYMER / PDB classification: HETAIN / Three letter code: K1S / Ideal coordinates details: Corina / Model coordinates PDB-ID: 5QJQ | ||||
History |
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External links | UniChem / BindingDB / ChEBI / ChEMBL / ChemicalBook / CompTox / DrugBank / HMDB / 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 3.385 | OpenEye OEToolkits 2.0.6 | |
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-SMILES CANONICAL
CACTVS 3.385 | OpenEye OEToolkits 2.0.6 | |
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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 2.0.6 | ~{ | |
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-PDB entries
Showing all 3 items
PDB-5qjq:
PanDDA analysis group deposition of models with modelled events (e.g. bound ligands) -- Crystal Structure of NUDT5 in complex with Z56791867
PDB-5rk4:
PanDDA analysis group deposition -- Crystal Structure of PHIP in complex with Z56791867
PDB-5smf:
PanDDA analysis group deposition -- Crystal Structure of SARS-CoV-2 NSP14 in complex with Z56791867