TPDB79985

noncanonical_tokenized modified

12 amino acids

TPDB ID TPDB79985

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

['ME_NVA','I','SAR','SAR','ME_CHA','SAR','HPH(4-CF3,3-CL)','P','AC5C','ME_CHG','MED','-PIP']

Source representation

>TPDB79985||length=12
['ME_NVA','I','SAR','SAR','ME_CHA','SAR','HPH(4-CF3,3-CL)','P','AC5C','ME_CHG','MED','-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

CCC[C@H]1C(=O)N[C@@H]([C@@H](C)CC)C(=O)N(C)CC(=O)N(C)CC(=O)N(C)[C@@H](CC2CCCCC2)C(=O)N(C)CC(=O)N[C@@H](CCc2ccc(C(F)(F)F)c(Cl)c2)C(=O)N2CCC[C@H]2C(=O)NC2(CCCC2)C(=O)N(C)[C@@H](C2CCCCC2)C(=O)N(C)[C@H](C(=O)N2CCCCC2)CC(=O)N1C Caco-2 permeability

Caco2

-6.070581074

MaxPartialCharge

0.417342355

MinPartialCharge

-0.342746283

Molecule_Shape

Lariat

MolWt

1428.191

Permeability

-6.070581074