ProForma 2.0
validated simple linear
MAARL
Record tools
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X-Pep derivative
65
Quality PepDiana 0–100 composite of sequence, source, activity, literature, and cross-database evidence completeness.
2
Source DBs
3
Activities
2
Source refs
1
Literature
0
Patents
Integrated record
Length
Molecular weight
Formula
Structure type
Synthesis
Chirality
Family
Gene
Residue composition
Physicochemical profile
Membrane affinity proxy
Solubility proxy
Net charge proxy +1
Binding interaction proxy
Versioned scientific descriptors
Legacy compatibility fields are materialized from the versioned PepDiana computed release; no separate source-reported property is available.
Molecular weight
560.7104 Da
Molecular formula
C23H44N8O6S
Theoretical pI
9.5001
Net charge at pH 7
0.5003
GRAVY
0.96
Instability index
32.68
Aromaticity
0
Topological polar surface area
241.62 Ų
cLogP
-1.5602
Hydrogen-bond donors
9
Hydrogen-bond acceptors
8
Rotatable bonds
18
Method: PepDiana sequence/structure descriptor pipeline
Tool: Biopython+RDKit · Biopython 1.85; RDKit 2024.09.6
Calculated: 2026-06-20T11:01:38.358971+00:00
Assumptions: ph=7; termini=free N-terminus and free C-terminus for simple linear peptides; stereochemistry=standard L-amino acids; smiles_length_limit=200
ProForma 2.0
validated simple linear
MAARL
HELM 2.0
validated simple linear
PEPTIDE1{M.A.A.R.L}$$$$V2.0
Canonical SMILES
validated
CSCCC(N)C(=O)NC(C)C(=O)NC(C)C(=O)NC(CCCNC(=N)N)C(=O)NC(CC(C)C)C(=O)O
Isomeric SMILES
validated
CSCC[C@H](N)C(=O)N[C@@H](C)C(=O)N[C@@H](C)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CC(C)C)C(=O)O
Follow-up research
Links open third-party resources with the current PepDiana sequence, record name, or chemistry notation as the initial query.
Research workflow
@misc{PEPDIA-INT-048951,
title = {X-Pep derivative},
author = {{PepDiana Consortium}},
year = {2026},
howpublished = {PepDiana Multifunctional Peptide Database},
url = {http://127.0.0.1:3004/peptides/PEPDIA-INT-048951},
note = {Accessed from local PepDiana development build}
}X-Pep derivative. (2026). PepDiana record PEPDIA-INT-048951. PepDiana Multifunctional Peptide Database. http://127.0.0.1:3004/peptides/PEPDIA-INT-048951
Integrated source-database annotations
| Stable record | Activity | Subtype | Value | Target | Assay method | Source |
|---|---|---|---|---|---|---|
| CTPDB_P048951_ACT_cppsite_0000 | Cell-Penetrating | CPP | Not available in the current structured import | Unknown | Not reported by source | 2904cppsite / linked |
| CTPDB_P048951_ACT_dramp_0001 | Antimicrobial | - | Not available in the current structured import | Unknown | Not reported by source | DRAMP35428dramp / linked |
| CTPDB_P048951_ACT_dramp_0002 | Anticancer | - | Not available in the current structured import | Unknown | Not reported by source | DRAMP35428dramp / linked |
Provenance
Citation trail
-
Audit surface
Integrated record last updated: 2026-04-15T00:59:17.756235+00:00
Modification summary
No structured modification annotations are available for this record.
[
{
"source_db": "cppsite",
"organism_name": "Unknown"
},
{
"source_db": "dramp",
"organism_name": "Unknown"
}
]