Ligand
Ligand Name:   PCM-0102274
Ligand Type:   non-polymer
Ligand ID:   COVPDB1371 PubChem:   737317
Synonym(s):  
  •   2-chloro-n-(2-chloropyridin-3-yl)acetamide
  • 379726-55-3
  • n1-(2-chloro-3-pyridyl)-2-chloroacetamide
  • 2-chloro-n-(2-chloro(3-pyridyl))acetamide
  • schembl1563197
  • dtxsid60353226
  • zinc166983
  • albb-002326
  • 2010ae
  • bbl017252
  • mfcd00104119
  • sbb003499
  • stk442588
  • akos001032706
  • mcule-9718436415
  • ls-01176
  • st056574
  • ab0172108
  • db-026733
  • 2-chloro-n-(2-chloro-3-pyridinyl)acetamide
  • ft-0757448
  • r2129
  • 2-chloro-n-(2-chloro-pyridin-3-yl)-acetamide
  • n-(2-chloro-pyridin-3-yl)-2-chloro-acetamide
  • f2158-1348
show 24 synonym(s)
DrugBank:   - ChEMBL:   -
Canonical SMILES:   ClCC(=O)Nc1cccnc1Cl
Standard InChI:   InChI=1S/C7H6Cl2N2O/c8-4-6(12)11-5-2-1-3-10-7(5)9/h1-3H,4H2,(H,11,12)
Molecular Formula:   C7H6Cl2N2O Mol. Weight:   203.98572 logP:   1.9123
HBD:   1 HBA:   2
#Rotatable Bonds:   2 TPSA:   41.99

Bound Proteins
Protein Name Uniprot ID/ACC Organism PDB ID HET Code Binding Affinity Binding Database Complex Card
Replicase polyprotein 1ab P0DTD1 (R1AB_SARS2) Severe acute respiratory syndrome coronavirus 2 (2019-nCoV) (SARS-CoV-2) 5RFZ T8V
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