COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK149414
Chemical Name: 2-nitro-11H-dibenzo[b,e][1,4]dioxepine
Smiles: [O-][N+](=O)c1ccc2c(c1)COc1c(O2)cccc1

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Molecular Weight: 243.22
Empirical Formula: C13H9NO4

Physical State: Dry powder
Available Amount: 159 mg

Lipinsky:
logP: 2.165
Rotatable bonds: 0
H-donors: 0
H-acceptors: 4
PSA: 64
Number of rings: 3

     

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