Ligand
Ligand Name:   4-[(4-oxo-2-sulfanylidene-1,3-thiazolidin-3-yl)methyl]benzonitrile
Ligand Type:   non-polymer
Ligand ID:   COVPDB103 PubChem:   2731175
Synonym(s):  
  •   schembl2908429
  • zinc1045148
  • ccg-237301
  • mcule-5222587951
show 3 synonym(s)
DrugBank:   - ChEMBL:   -
Canonical SMILES:   O=C1CSC(=S)N1Cc2ccc(C#N)cc2
Standard InChI:   InChI=1S/C11H8N2OS2/c12-5-8-1-3-9(4-2-8)6-13-10(14)7-16-11(13)15/h1-4H,6-7H2
Molecular Formula:   C11H8N2OS2 Mol. Weight:   248.00781 logP:   1.91858
HBD:   0 HBA:   4
#Rotatable Bonds:   2 TPSA:   44.1

Bound Proteins
Protein Name Uniprot ID/ACC Organism PDB ID HET Code Binding Affinity Binding Database Complex Card
Macrophage migration inhibitory factor P14174 (MIF_HUMAN) Homo sapiens (Human) 4P01 1ZW
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