10967/177 - QDB Compounds

QsarDB Repository

Gramatica, P.; Cassani, S.; Chirico, N. QSARINS-chem: Insubria datasets and new QSAR/QSPR models for environmental pollutants in QSARINS. J. Comput. Chem. 2014, 35, 1036–1044.

Compound

ID:1277
Name:9-methylphenanthrene
Description:IUPAC names and InChI codes were generated with InstantJChem Original name was: 9-methylphenanthrene
Labels:
CAS:883-20-5
InChi Code:InChI=1S/C15H12/c1-11-10-12-6-2-3-8-14(12)15-9-5-4-7-13(11)15/h2-10H,1H3

Properties

M5.logHLn: Biotransformation half-lives in fish

ValueSource or prediction
0.117492161

experimental value

0.346

Tab2.Model_5: Metab. biotransf. fish (Training set)

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