COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK790793
Chemical Name: (2Z)-5-amino-2-(4-nitrobenzylidene)-7-(4-nitrophenyl)-3-oxo-2,3-dihydro-7H-[1,3]thiazolo[3,2-a]pyridine-6,8-dicarbonitrile
Smiles: N#CC1=C(N)n2c(=C(C1c1ccc(cc1)[N+](=O)[O-])C#N)s/c(=C\c1ccc(cc1)[N+](=O)[O-])/c2=O

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Molecular Weight: 472.44
Empirical Formula: C22H12N6O5S

Physical State: Dry powder
Available Amount: 55 mg

Lipinsky:
logP: 4.453
Rotatable bonds: 0
H-donors: 2
H-acceptors: 5
PSA: 210
Number of rings: 4

     

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