BIOPEP-UWM: Virtual Peptide Data
ID
Name
Sequence
QADPKTFYGLM
Chemical Mass
Number of residues
Monoisotopic Mass
EC50
IC50
µM
Additional Information
BIOPEP-UWM Virtual database SMILES: N[C@@]([H])(CCC(=O)N)C(=O)N[C@@]([H])(C)C(=O)N[C@@]([H])(CC(=O)O)C(=O)N1[C@@]([H])(CCC1)C(=O)N[C@@]([H])(CCCCN)C(=O)N[C@@]([H])([C@]([H])(O)C)C(=O)N[C@@H](CC1=CC=C(C=C1))C(=O)N[C@@H](CC1=CC=C(C=C1)O)C(=O)NCC(=O)N[C@@]([H])(CC(C)C)C(=O)N[C@@]([H])(CCSC)C(=O)O InChI=1S/C58H87N13O17S/c1-31(2)26-40(53(82)66-39(58(87)88)22-25-89-5)64-46(75)30-62-51(80)41(28-35-16-18-36(73)19-17-35)67-54(83)42(27-34-12-7-6-8-13-34)68-56(85)48(33(4)72)70-52(81)38(14-9-10-23-59)65-55(84)44-15-11-24-71(44)57(86)43(29-47(76)77)69-49(78)32(3)63-50(79)37(60)20-21-45(61)74/h6-8,12-13,16-19,31-33,37-44,48,72-73H,9-11,14-15,20-30,59-60H2,1-5H3,(H2,61,74)(H,62,80)(H,63,79)(H,64,75)(H,65,84)(H,66,82)(H,67,83)(H,68,85)(H,69,78)(H,70,81)(H,76,77)(H,87,88)/t32-,33+,37-,38-,39-,40-,41-,42-,43-,44-,48-/m0/s1 InChIKey=FECWYOLDHDGRDU-UTSVTYMMSA-N Bioactivity predicted using molecular docking
activity
references
function information
database references
screen and print virtual peptide data
list of virtual peptides