BIOPEP-UWM: Virtual Peptide Data
ID
Name
Sequence
KNQDKTEIP
Chemical Mass
Number of residues
Monoisotopic Mass
EC50
IC50
µM
Additional Information
BIOPEP-UWM database of bioactive peptides SMILES: N[C@@]([H])(CCCCN)C(=O)N[C@@]([H])(CC(=O)N)C(=O)N[C@@]([H])(CCC(=O)N)C(=O)N[C@@]([H])(CC(=O)O)C(=O)N[C@@]([H])(CCCCN)C(=O)N[C@@]([H])([C@]([H])(O)C)C(=O)N[C@@]([H])(CCC(=O)O)C(=O)N[C@@]([H])([C@]([H])(CC)C)C(=O)N1[C@@]([H])(CCC1)C(=O)O InChI=1S/C45H77N13O17/c1-4-22(2)35(44(73)58-19-9-12-30(58)45(74)75)56-40(69)27(14-16-33(62)63)53-43(72)36(23(3)59)57-39(68)25(11-6-8-18-47)51-42(71)29(21-34(64)65)55-38(67)26(13-15-31(49)60)52-41(70)28(20-32(50)61)54-37(66)24(48)10-5-7-17-46/h22-30,35-36,59H,4-21,46-48H2,1-3H3,(H2,49,60)(H2,50,61)(H,51,71)(H,52,70)(H,53,72)(H,54,66)(H,55,67)(H,56,69)(H,57,68)(H,62,63)(H,64,65)(H,74,75)/t22-,23+,24-,25-,26-,27-,28-,29-,30-,35-,36-/m0/s1 InChIKey=JMMHMWVPZSORAE-CZMZNCBOSA-N Activity predicted using molecular docking
activity
references
function information
database references
screen and print virtual peptide data
list of virtual peptides