Ligand
Ligand Name:   PCM-0102190
Ligand Type:   non-polymer
Ligand ID:   COVPDB1360 PubChem:   7063653
Synonym(s):  
  •   zinc3888029
  • akos019946486
show 1 synonym(s)
DrugBank:   - ChEMBL:   -
Canonical SMILES:   ClCC(=O)N[C@H](C)c1cccc(Cl)c1
Standard InChI:   InChI=1S/C10H11Cl2NO/c1-7(13-10(14)6-11)8-3-2-4-9(12)5-8/h2-5,7H,6H2,1H3,(H,13,14)/t7-/m1/s1
Molecular Formula:   C10H11Cl2NO Mol. Weight:   231.02177 logP:   2.756
HBD:   1 HBA:   1
#Rotatable Bonds:   3 TPSA:   29.1

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) 5RFP T7V
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