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Citation
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HERO ID
661835
Reference Type
Journal Article
Title
QSAR modelling of the ERL-D fathead minnow acute toxicity database
Author(s)
Nendza, M; Russom, CL
Year
1991
Is Peer Reviewed?
1
Journal
Xenobiotica
ISSN:
0049-8254
EISSN:
1366-5928
Report Number
BIOSIS/91/13604
Book Title
Xenobiotica
Volume
21
Issue
2
Page Numbers
147-170
Language
English
PMID
2058173
DOI
10.3109/00498259109039458
Abstract
BIOSIS COPYRIGHT: BIOL ABS. Regression analysis has been applied to examine the structure-activity relationships regarding the acute fish toxicity (96 h LC50 fathead minnow) of organic chemicals. The log P dependent baseline toxicity model has been confirmed for a data set composed of 618 compounds from 24 chemical classes associated with a putative common mode of action. Covariance analysis of the discrete by class regression functions resulted in the combination of chemicals to subsets associated with their mode of action. Separate models were derived for nonpolar (Class I) and polar (Class II and III) compounds. Chemicals which are more toxic than estimated from the baseline model are identified.
Keywords
Mathematics; Statistics; Biology; Biochemistry; Biophysics; Macromolecular systems; Molecular biology; Poisoning; Animals; laboratory; Environmental pollutants poisoning; Occupational diseases; Air pollution; Soil pollutants; Water pollution; Fishes; 42454-06-8; 42087-80-9; 22726-00-7; 10031-82-0; 6361-21-3; 4460-86-0; 4412-91-3; 4117-14-0; 2973-76-4; 2905-69-3; 2150-47-2; 2008-58-4; 1871-57-4; 1761-61-1; 1647-16-1; 1634-04-4; 920-66-1; 874-42-0; 868-77-9; 822-86-6; 818-72-4; 764-01-2; 761-65-9; 760-23-6; 700-58-3; 693-65-2; 683-72-7; 653-37-2; 635-93-8; 629-04-9; 628-76-2; 627-30-5; 625-86-5; 620-88-2; 619-80-7; 613-45-6; 600-36-2; 592-46-1; 590-86-3; 555-16-8; 552-89-6; 532-32-1; 529-20-4; 525-82-6; 513-81-5; 498-66-8; 496-16-2; 470-82-6; 454-89-7; 446-52-6; 387-45-1; 281-23-2; 271-89-6; 148-53-8; 142-96-1; 142-92-7; 142-62-1; 142-28-9; 141-78-6; 141-28-6; 141-03-7; 137-40-6; 134-62-3; 132-64-9; 127-66-2; 127-18-4; 127-00-4; 124-19-6; 123-86-4; 123-72-8; 123-66-0; 123-15-9; 122-99-6; 122-03-2; 121-33-5; 121-32-4; 118-61-6; 115-20-8; 115-19-5; 112-30-1; 112-05-0; 111-87-5; 111-83-1; 111-70-6; 111-27-3; 111-25-1; 111-15-9; 110-82-7; 110-62-3; 110-56-5; 110-54-3; 110-40-7; 109-99-9; 109-65-9; 109-64-8; 109-60-4; 108-94-1; 108-93-0; 108-20-3; 108-10-1; 107-07-3; 107-06-2; 106-94-5; 105-99-7; 105-53-3; 104-88-1; 104-76-7; 101-84-8; 100-52-7; 100-10-7; 96-22-0; 96-13-9; 96-05-9; 95-01-2; 94-09-7; 90-59-5; 90-02-8; 88-68-6; 87-68-3; 84-66-2; 84-62-8; 83-79-4; 79-34-5; 79-20-9; 79-01-6; 79-00-5; 78-92-2; 78-87-5; 78-83-1; 77-75-8; 77-74-7; 76-01-7; 75-89-8; 75-65-0; 75-47-8; 75-09-2; 71-55-6; 71-41-0; 71-36-3; 71-23-8; 69-72-7; 67-72-1; 67-66-3; 67-63-0; 66-76-2; 66-25-1; 60-29-7; 58-27-5; 57-15-8; 55-21-0
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