COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK792985
Chemical Name: 2-[4-(2-chloro-1,1,1,3,3,3-hexafluoropropan-2-yl)-2,6-dinitrophenyl]-1,2-oxazinane
Smiles: [O-][N+](=O)c1cc(cc(c1N1CCCCO1)[N+](=O)[O-])C(C(F)(F)F)(C(F)(F)F)Cl

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Molecular Weight: 437.68
Empirical Formula: C13H10ClF6N3O5

Physical State: Dry powder
Available Amount: 311 mg

Lipinsky:
logP: 2.338
Rotatable bonds: 0
H-donors: 0
H-acceptors: 5
PSA: 104
Number of rings: 2

     

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