Ligand
Ligand Name:   N-[2-({[5-(DIMETHYLAMINO)NAPHTHALEN-1-YL]SULFONYL}AMINO)ETHYL]-2-IODOACETAMIDE
Ligand Type:   non-polymer
Ligand ID:   COVPDB214 PubChem:   49866503
Synonym(s):   -
DrugBank:   - ChEMBL:   CHEMBL1230210
Canonical SMILES:   CN(C)c1cccc(c12)c(ccc2)S(=O)(=O)NCCNC(=O)CI
Standard InChI:   InChI=1S/C16H20IN3O3S/c1-20(2)14-7-3-6-13-12(14)5-4-8-15(13)24(22,23)19-10-9-18-16(21)11-17/h3-8,19H,9-11H2,1-2H3,(H,18,21)
Molecular Formula:   C16H20IN3O3S Mol. Weight:   461.027 logP:   1.7353
HBD:   2 HBA:   4
#Rotatable Bonds:   7 TPSA:   78.51

Bound Proteins
Protein Name Uniprot ID/ACC Organism PDB ID HET Code Binding Affinity Binding Database Complex Card
Uncharacterized protein Q8VK10 (Q8VK10_MYCTO) Mycobacterium tuberculosis (strain CDC 1551 / Oshkosh) 2YJ0 420
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