COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK065021
Chemical Name: 1-(7-nitro-2,3-dihydro-1,4-benzodioxin-6-yl)ethylacetate
Smiles: CC(=O)OC(c1cc2OCCOc2cc1[N+](=O)[O-])C

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Molecular Weight: 267.24
Empirical Formula: C12H13NO6

Physical State: Dry powder
Available Amount: 127 mg

Lipinsky:
logP: 2.142
Rotatable bonds: 3
H-donors: 0
H-acceptors: 6
PSA: 90
Number of rings: 2

     

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