BIOPEP-UWM: Virtual Peptide Data
ID
Name
Sequence
GPPKVAPGKDISASFGGEWL
Chemical Mass
Number of residues
Monoisotopic Mass
EC50
IC50
µM
Additional Information
BIOPEP-UWM Virtual database SMILES: NCC(=O)N1[C@@]([H])(CCC1)C(=O)N1[C@@]([H])(CCC1)C(=O)N[C@@]([H])(CCCCN)C(=O)N[C@@]([H])(C(C)C)C(=O)N[C@@]([H])(C)C(=O)N1[C@@]([H])(CCC1)C(=O)NCC(=O)N[C@@]([H])(CCCCN)C(=O)N[C@@]([H])(CC(=O)O)C(=O)N[C@@]([H])([C@]([H])(CC)C)C(=O)N[C@@]([H])(CO)C(=O)N[C@@]([H])(C)C(=O)N[C@@]([H])(CO)C(=O)N[C@@H](CC1=CC=C(C=C1))C(=O)NCC(=O)NCC(=O)N[C@@]([H])(CCC(=O)O)C(=O)N[C@@H](CC1=C[NH]C2=CC=CC=C12)C(=O)N[C@@]([H])(CC(C)C)C(=O)O InChI=1S/C93H141N23O27/c1-9-51(6)77(113-84(133)63(41-75(125)126)108-80(129)58(26-15-17-33-94)103-72(121)46-100-87(136)67-28-19-36-115(67)91(140)53(8)102-89(138)76(50(4)5)112-82(131)59(27-16-18-34-95)105-88(137)68-29-20-37-116(68)92(141)69-30-21-35-114(69)73(122)42-96)90(139)111-65(47-117)85(134)101-52(7)78(127)110-66(48-118)86(135)106-61(39-54-22-11-10-12-23-54)79(128)99-44-70(119)98-45-71(120)104-60(31-32-74(123)124)81(130)107-62(83(132)109-64(93(142)143)38-49(2)3)40-55-43-97-57-25-14-13-24-56(55)57/h10-14,22-25,43,49-53,58-69,76-77,97,117-118H,9,15-21,26-42,44-48,94-96H2,1-8H3,(H,98,119)(H,99,128)(H,100,136)(H,101,134)(H,102,138)(H,103,121)(H,104,120)(H,105,137)(H,106,135)(H,107,130)(H,108,129)(H,109,132)(H,110,127)(H,111,139)(H,112,131)(H,113,133)(H,123,124)(H,125,126)(H,142,143)/t51-,52-,53-,58-,59-,60-,61-,62-,63-,64-,65-,66-,67-,68-,69-,76-,77-/m0/s1 InChIKey=RAPAMDBPZUNGDO-NYCBWBEESA-N Bioactivity predicted using molecular docking
activity
references
function information
database references
screen and print virtual peptide data
list of virtual peptides