Ligand
Ligand Name:   Suc-Val-Pro-LysP-(OPh)2
Ligand Type:   non-polymer
Ligand ID:   COVPDB20 PubChem:   25108695
Synonym(s):  
  •   n-[(3s)-1-fluoro-2-oxo-5-phenylpentan-3-yl]-n~2~-(morpholin-4-ylcarbonyl)-l-leucinamide
  • morpholino-leu-homophe-fmk
  • q27451105
show 2 synonym(s)
DrugBank:   - ChEMBL:   -
Canonical SMILES:   C1COCCN1C(=O)N[C@@H](CC(C)C)C(=O)N[C@H](C(=O)CF)CCc2ccccc2
Standard InChI:   InChI=1S/C22H32FN3O4/c1-16(2)14-19(25-22(29)26-10-12-30-13-11-26)21(28)24-18(20(27)15-23)9-8-17-6-4-3-5-7-17/h3-7,16,18-19H,8-15H2,1-2H3,(H,24,28)(H,25,29)/t18-,19-/m0/s1
Molecular Formula:   C22H32FN3O4 Mol. Weight:   421.23767 logP:   2.0991
HBD:   2 HBA:   4
#Rotatable Bonds:   10 TPSA:   87.74

Bound Proteins
Protein Name Uniprot ID/ACC Organism PDB ID HET Code Binding Affinity Binding Database Complex Card
Cruzipain P25779 (CYSP_TRYCR) Trypanosoma cruzi 1EWP 0I5
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