COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL434038
Chemical Name: 8-nitro-2,3-dihydro-1,4-benzodioxine-6-carbonitrile
Smiles: N#Cc1cc2OCCOc2c(c1)[N+](=O)[O-]

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Molecular Weight: 206.16
Empirical Formula: C9H6N2O4

Physical State: Dry powder
Available Amount: 55 mg

Lipinsky:
logP: 1.185
Rotatable bonds: 0
H-donors: 0
H-acceptors: 4
PSA: 88
Number of rings: 2

     

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