Structure-activity relationships for rat and mouse LD50 of miscellaneous alcohols

Wang, G; Bai, N

HERO ID

1580276

Reference Type

Journal Article

Year

1998

Language

English

PMID

9503576

HERO ID 1580276
In Press No
Year 1998
Title Structure-activity relationships for rat and mouse LD50 of miscellaneous alcohols
Authors Wang, G; Bai, N
Journal Chemosphere
Volume 36
Issue 7
Page Numbers 1475-1483
Abstract Structure-activity relationships between acute toxicities of 95 alcohols to rat and mouse (oral LD50) and four special substructure factors, hydroxyl number, carbon atom number were examined by means of expert system method. The results showed that the expert system based QSAR model was excellent for classification for miscellaneous alcohols (only 9 of them were wrong classified). It was also used to predict the toxicity of other 25 alcohols, and the false prediction rate was only 12%.
Doi 10.1016/S0045-6535(97)10046-7
Pmid 9503576
Wosid WOS:000072217400001
Is Certified Translation No
Dupe Override No
Is Public Yes
Language Text English
Keyword QSAR; Expert system; Alcohols
Relationship(s)