COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK020689
Chemical Name: (4,5-dimethoxy-2-nitrobenzylidene)propanedinitrile
Smiles: N#CC(=Cc1cc(OC)c(cc1[N+](=O)[O-])OC)C#N

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Molecular Weight: 259.22
Empirical Formula: C12H9N3O4

Physical State: Dry powder
Available Amount: 463 mg

Lipinsky:
logP: 1.821
Rotatable bonds: 3
H-donors: 0
H-acceptors: 4
PSA: 111
Number of rings: 1

     

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