COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK790886
Chemical Name: methyl(2Z)-5-amino-6-cyano-2-(3-nitrobenzylidene)-7-(3-nitrophenyl)-3-oxo-2,3-dihydro-7H-[1,3]thiazolo[3,2-a]pyridine-8-carboxylate
Smiles: COC(=O)C1=c2s/c(=C\c3cccc(c3)[N+](=O)[O-])/c(=O)n2C(=C(C1c1cccc(c1)[N+](=O)[O-])C#N)N

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Molecular Weight: 505.47
Empirical Formula: C23H15N5O7S

Physical State: Dry powder
Available Amount: 35 mg

Lipinsky:
logP: 4.429
Rotatable bonds: 4
H-donors: 2
H-acceptors: 7
PSA: 213
Number of rings: 4

     

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