BIOPEP-UWM: Virtual Peptide Data
ID
Name
Sequence
CQRKTAPY
Chemical Mass
Number of residues
Monoisotopic Mass
EC50
IC50
µM
Additional Information
BIOPEP-UWM Virtual database SMILES: N[C@@]([H])(CS)C(=O)N[C@@]([H])(CCC(=O)N)C(=O)N[C@@]([H])(CCCNC(=N)N)C(=O)N[C@@]([H])(CCCCN)C(=O)N[C@@]([H])([C@]([H])(O)C)C(=O)N[C@@]([H])(C)C(=O)N1[C@@]([H])(CCC1)C(=O)N[C@@H](CC1=CC=C(C=C1)O)C(=O)O InChI=1S/C41H67N13O12S/c1-21(39(64)54-18-6-9-30(54)37(62)52-29(40(65)66)19-23-10-12-24(56)13-11-23)48-38(63)32(22(2)55)53-36(61)26(7-3-4-16-42)50-34(59)27(8-5-17-47-41(45)46)51-35(60)28(14-15-31(44)57)49-33(58)25(43)20-67/h10-13,21-22,25-30,32,55-56,67H,3-9,14-20,42-43H2,1-2H3,(H2,44,57)(H,48,63)(H,49,58)(H,50,59)(H,51,60)(H,52,62)(H,53,61)(H,65,66)(H4,45,46,47)/t21-,22+,25-,26-,27-,28-,29-,30-,32-/m0/s1 InChIKey=OTEGRUOPCOVILJ-FQVUTMODSA-N Bioactivity predicted using molecular docking
activity
references
function information
database references
screen and print virtual peptide data
list of virtual peptides