10967/127 - QDB Compounds

QsarDB Repository

Bhhatarai, B.; Gramatica, P. Modelling physico-chemical properties of (benzo)triazoles, and screening for environmental partitioning. Water Res. 2011, 45, 3, 1463–1471.

Compound

ID:000288-36-8
Name:2H-triazole
Description:InChI code and name were downloaded from http://cactus.nci.nih.gov
Labels:
CAS:288-36-8
InChi Code:InChI=1S/C2H3N3/c1-2-4-5-3-1/h1-2H,(H,3,4,5)

Properties

logKow: Octanol/water partition coefficient as logKow

ValueSource or prediction
-0.29

experimental value

-0.1

Eq2: Model for octanol/water partition coefficient (Training set)