COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK045431
Chemical Name: 1-(7-nitro-2,3-dihydro-1,4-benzodioxin-6-yl)ethanone
Smiles: [O-][N+](=O)c1cc2OCCOc2cc1C(=O)C

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Molecular Weight: 223.19
Empirical Formula: C10H9NO5

Physical State: Dry powder
Available Amount: 338 mg

Lipinsky:
logP: 1.836
Rotatable bonds: 1
H-donors: 0
H-acceptors: 5
PSA: 81
Number of rings: 2

     

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