BIOPEP-UWM: Virtual Peptide Data
ID
Name
Sequence
SEKTTMPLW
Chemical Mass
Number of residues
Monoisotopic Mass
EC50
IC50
µM
Additional Information
BIOPEP-UWM Virtual database SMILES: N[C@@]([H])(CO)C(=O)N[C@@]([H])(CCC(=O)O)C(=O)N[C@@]([H])(CCCCN)C(=O)N[C@@]([H])([C@]([H])(O)C)C(=O)N[C@@]([H])([C@]([H])(O)C)C(=O)N[C@@]([H])(CCSC)C(=O)N1[C@@]([H])(CCC1)C(=O)N[C@@]([H])(CC(C)C)C(=O)N[C@@H](CC1=C[NH]C2=CC=CC=C12)C(=O)O InChI=1S/C49H77N11O15S/c1-25(2)21-35(44(69)57-36(49(74)75)22-28-23-52-31-12-7-6-11-29(28)31)56-45(70)37-14-10-19-60(37)48(73)34(17-20-76-5)55-46(71)39(26(3)62)59-47(72)40(27(4)63)58-43(68)32(13-8-9-18-50)54-42(67)33(15-16-38(64)65)53-41(66)30(51)24-61/h6-7,11-12,23,25-27,30,32-37,39-40,52,61-63H,8-10,13-22,24,50-51H2,1-5H3,(H,53,66)(H,54,67)(H,55,71)(H,56,70)(H,57,69)(H,58,68)(H,59,72)(H,64,65)(H,74,75)/t26-,27-,30+,32+,33+,34+,35+,36+,37+,39+,40+/m1/s1 InChIKey=MJPXEWBGKZQTFQ-IMHUTUBHSA-N Bioactivity predicted by molecular docking
activity
references
function information
database references
screen and print virtual peptide data
list of virtual peptides
Virtual peptides links
Virt 351