BIOPEP-UWM: Virtual Peptide Data
ID
Name
Sequence
MMPY
Chemical Mass
Number of residues
Monoisotopic Mass
EC50
IC50
µM
Additional Information
BIOPEP-UWM Virtual database SMILES: N[C@@]([H])(CCSC)C(=O)N[C@@]([H])(CCSC)C(=O)N1[C@@]([H])(CCC1)C(=O)N[C@@H](CC1=CC=C(C=C1)O)C(=O)O InChI=1S/C24H36N4O6S2/c1-35-12-9-17(25)21(30)26-18(10-13-36-2)23(32)28-11-3-4-20(28)22(31)27-19(24(33)34)14-15-5-7-16(29)8-6-15/h5-8,17-20,29H,3-4,9-14,25H2,1-2H3,(H,26,30)(H,27,31)(H,33,34)/t17-,18-,19-,20-/m0/s1 InChIKey=CJNANIUWLKGAHG-MUGJNUQGSA-N Bioactivity predicted by molecular docking Predicted inhibitor of pancreatic lipase (EC 3.4.23.1) (PDB ID: 1ETH) according to the BIOPEP-UWM Virtual database (ID 381)
activity
references
function information
database references
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list of virtual peptides
Virtual peptides links
Virt 381