BIOPEP-UWM: Virtual Peptide Data
ID
Name
Sequence
LNFDPNR
Chemical Mass
Number of residues
Monoisotopic Mass
EC50
IC50
µM
Additional Information
BIOPEP-UWM Virtual database SMILES: N[C@@]([H])(CC(C)C)C(=O)N[C@@]([H])(CC(=O)N)C(=O)N[C@@H](CC1=CC=C(C=C1))C(=O)N[C@@]([H])(CC(=O)O)C(=O)N1[C@@]([H])(CCC1)C(=O)N[C@@]([H])(CC(=O)N)C(=O)N[C@@]([H])(CCCNC(=N)N)C(=O)O InChI=1S/C38H58N12O12/c1-19(2)14-21(39)31(55)46-24(16-28(40)51)34(58)47-23(15-20-8-4-3-5-9-20)32(56)49-26(18-30(53)54)36(60)50-13-7-11-27(50)35(59)48-25(17-29(41)52)33(57)45-22(37(61)62)10-6-12-44-38(42)43/h3-5,8-9,19,21-27H,6-7,10-18,39H2,1-2H3,(H2,40,51)(H2,41,52)(H,45,57)(H,46,55)(H,47,58)(H,48,59)(H,49,56)(H,53,54)(H,61,62)(H4,42,43,44)/t21-,22-,23-,24-,25-,26-,27-/m0/s1 InChIKey=MADOKIJUOVLRMG-DUJSLOSMSA-N Bioactivity predicted by molecular docking Predicted inhibitor of Dipeptidyl peptidase IV (EC 3.4.14.5) (MEROPS ID: S09.003) (PDB ID: 5I7U) according to the BIOPEP-UWM Virtual database
activity
references
function information
database references
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list of virtual peptides
Virtual peptides links
Virt 155