Ligand
Ligand Name:   3-{[(4-cyanophenyl)methyl](1-oxo-1,2-dihydroisoquinolin-7-yl)sulfamoyl}benzene-1-sulfonyl fluoride
Ligand Type:   non-polymer
Ligand ID:   COVPDB757 PubChem:   -
Synonym(s):   -
DrugBank:   - ChEMBL:   -
Canonical SMILES:   N#Cc(cc1)ccc1CN(S(=O)(=O)c(cc2S(=O)(=O)F)ccc2)c(c3)ccc(c34)cc[nH]c4=O
Standard InChI:   InChI=1S/C23H16FN3O5S2/c24-33(29,30)20-2-1-3-21(13-20)34(31,32)27(15-17-6-4-16(14-25)5-7-17)19-9-8-18-10-11-26-23(28)22(18)12-19/h1-13H,15H2,(H,26,28)
Molecular Formula:   C23H16FN3O5S2 Mol. Weight:   497.05154 logP:   3.45348
HBD:   1 HBA:   6
#Rotatable Bonds:   6 TPSA:   128.17

Bound Proteins
Protein Name Uniprot ID/ACC Organism PDB ID HET Code Binding Affinity Binding Database Complex Card
Eukaryotic translation initiation factor 4E P63073 (IF4E_MOUSE) Mus musculus (Mouse) 6U06 EI8
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