TPDB81523

noncanonical_tokenized modified

12 amino acids

TPDB ID TPDB81523

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

['SAR','ME_PHE(3-CL)','NLE(OH)','MEV','T','PR_GLY','ME_HPH','MEL','SER(ISOAMYL)','MEL','D','-PIP']

Source representation

>TPDB81523||length=12
['SAR','ME_PHE(3-CL)','NLE(OH)','MEV','T','PR_GLY','ME_HPH','MEL','SER(ISOAMYL)','MEL','D','-PIP']

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

CCCN1CC(=O)N(C)[C@@H](CCc2ccccc2)C(=O)N(C)[C@@H](CC(C)C)C(=O)N[C@@H](COCCC(C)C)C(=O)N(C)[C@@H](CC(C)C)C(=O)N[C@H](C(=O)N2CCCCC2)CC(=O)N(C)CC(=O)N(C)[C@@H](Cc2cccc(Cl)c2)C(=O)N[C@@H](CCCCO)C(=O)N(C)[C@@H](C(C)C)C(=O)N[C@@H]([C@@H](C)O)C1=O Caco-2 permeability

Caco2

-6.68

MaxPartialCharge

0.247806845

MinPartialCharge

-0.396376556

Molecule_Shape

Lariat

MolWt

1478.326

Permeability

-6.68