Ligand
Ligand Name:   2-azido-N-(2-{[2-(2-azidoacetamido)ethyl]disulfanyl}ethyl)acetamide
Ligand Type:   non-polymer
Ligand ID:   COVPDB679 PubChem:   -
Synonym(s):   -
DrugBank:   - ChEMBL:   -
Canonical SMILES:   [N-]=[N+]=NCC(=O)NCCSSCCNC(=O)CN=[N+]=[N-]
Standard InChI:   InChI=1S/C8H14N8O2S2/c9-15-13-5-7(17)11-1-3-19-20-4-2-12-8(18)6-14-16-10/h1-6H2,(H,11,17)(H,12,18)
Molecular Formula:   C8H14N8O2S2 Mol. Weight:   318.0681 logP:   1.2208
HBD:   2 HBA:   6
#Rotatable Bonds:   11 TPSA:   155.72

Bound Proteins
Protein Name Uniprot ID/ACC Organism PDB ID HET Code Binding Affinity Binding Database Complex Card
Carbonic anhydrase 2 P00918 (CAH2_HUMAN) Homo sapiens (Human) 3KIG DA9
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