TPDB79463

noncanonical_tokenized modified

12 amino acids

TPDB ID TPDB79463

Activity

Activity_category_statistics

Database_Source

CycPeptMPDB_Caco2

Sequence_Type

noncanonical_tokenized

Has_Modification Yes

Description A 12-aa noncanonical peptide sequence curated from CycPeptMPDB_Caco2, without an available 3D structural model.

Sequence

['MEL','I','MEA','AZE','ET_PHE(4-ME)','SAR','HPH(4-CF3,3,5-DIF)','P','AC5C','ME_GLY(CPENT)','MED','-NME2']

Source representation

>TPDB79463||length=12
['MEL','I','MEA','AZE','ET_PHE(4-ME)','SAR','HPH(4-CF3,3,5-DIF)','P','AC5C','ME_GLY(CPENT)','MED','-NME2']

Sequence-only estimates are not provided for modified or non-standard source notation. Reported molecular properties, when available, are retained below with their source records.

Length

12 reviewed residue count

SMILES

CC[C@H](C)[C@@H]1NC(=O)[C@H](CC(C)C)N(C)C(=O)C[C@@H](C(=O)N(C)C)N(C)C(=O)[C@H](C2CCCC2)N(C)C(=O)C2(CCCC2)NC(=O)[C@@H]2CCCN2C(=O)[C@H](CCc2cc(F)c(C(F)(F)F)c(F)c2)NC(=O)CN(C)C(=O)[C@H](Cc2ccc(C)cc2)N(CC)C(=O)[C@@H]2CCN2C(=O)[C@H](C)N(C)C1=O Caco-2 permeability

Caco2

-5.638272164

MaxPartialCharge

0.421556689

MinPartialCharge

-0.34701889

Molecule_Shape

Lariat

MolWt

1437.705

Permeability

-5.638272164