QikProp data for reference pteridines and N10-, PABA- and tail-modified series compounds

Results of default run of Schrödinger QikProp (Schrödinger, LLC, New York, NY, Schrödinger Release 2015-4, 2015, QikProp v4.6.) for reference pteridines (series 1) and newly synthesized N10-, PABA and tail-modified pteridines (series 2, 3 and 4). QikProp in silico predicts various physico-chemical compound properties and advanced descriptors related to administration, distribution, metabolism, excretion and toxicity of the compounds.

SEEK ID: https://fairdomhub.org/data_files/3808?version=2

Filename: qikprop-results_reference-new-pteridines.csv  Download

Format: Comma-separated values document

Size: 7.27 KB

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Created: 19th Aug 2020 at 13:30

Last updated: 16th Jul 2021 at 10:47

Last used: 14th Aug 2022 at 00:59

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Version History

Version 2 (latest) Created 16th Jul 2021 at 10:47 by Ina Poehner

Updated nomenclature

Version 1 (earliest) Created 19th Aug 2020 at 13:30 by Ina Poehner

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