compound 15 [PMID: 29852070]

Ligand id: 9997

Name: compound 15 [PMID: 29852070]

Structure and Physico-chemical Properties

2D Structure
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Calculated Physico-chemical Properties
Hydrogen bond acceptors 7
Hydrogen bond donors 1
Rotatable bonds 6
Topological polar surface area 133.06
Molecular weight 433.11
XLogP 1.92
No. Lipinski's rules broken 0

Molecular properties generated using the CDK

References
1. Knight ZA, Gonzalez B, Feldman ME, Zunder ER, Goldenberg DD, Williams O, Loewith R, Stokoe D, Balla A, Toth B et al.. (2006)
A pharmacological map of the PI3-K family defines a role for p110alpha in insulin signaling.
Cell, 125 (4): 733-47. [PMID:16647110]
2. Pemberton N, Mogemark M, Arlbrandt S, Bold P, Cox RJ, Gardelli C, Holden NS, Karabelas K, Karlsson J, Lever S et al.. (2018)
Discovery of Highly Isoform Selective Orally Bioavailable Phosphoinositide 3-Kinase (PI3K)-γ Inhibitors.
J. Med. Chem., 61 (12): 5435-5441. [PMID:29852070]