Published April 28, 2026
| Version NORMAN-SLE-S134.0.1.2
Dataset
Open
S134 | GCIPMTTPS | Prioritized Dead-end TPs from the ZeroPM Global Chemical Inventory
Authors/Creators
Description
A list of predicted "dead-end" transformation products (TPs) from the ZeroPM Global Chemical Inventory (GCI), prioritized to be potentially persistent (as they are "dead-end"), mobile (logKoc) and/or toxic (ED), both predicted with OPERA. See https://gcitps.lcsb.uni.lu/.
TPs from the ZeroPM GCI (https://database.zeropm.eu/) were predicted over 3 reaction steps (env, abiotic) with BioTransformer 4.0 (beta veresion). The full database is available at https://gcitps.lcsb.uni.lu/. v0.1.1: added precursor mapping file. v0.1.2 added CIDs, names.
Files
GCIPMTTPS.csv
Additional details
Related works
- Is derived from
- Other: http://biotransformer.ca/ (URL)
- Other: https://database.zeropm.eu/ (URL)
- Is supplement to
- Other: https://gcitps.lcsb.uni.lu/ (URL)