compound 1d [PMID: 21493067]

Ligand id: 8123

Name: compound 1d [PMID: 21493067]

Structure and Physico-chemical Properties

2D Structure
Calculated Physico-chemical Properties
Hydrogen bond acceptors 7
Hydrogen bond donors 3
Rotatable bonds 5
Topological polar surface area 102.31
Molecular weight 355.14
XLogP 3.26
No. Lipinski's rules broken 0

Molecular properties generated using the CDK

References
1. Wang T, Ioannidis S, Almeida L, Block MH, Davies AM, Lamb ML, Scott DA, Su M, Zhang HJ, Alimzhanov M et al.. (2011)
In vitro and in vivo evaluation of 6-aminopyrazolyl-pyridine-3-carbonitriles as JAK2 kinase inhibitors.
Bioorg. Med. Chem. Lett.21 (10): 2958-61. [PMID:21493067]