COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK859917
Chemical Name: ethyl4-[(7Z)-7-(4-nitrobenzylidene)-6-oxo-6,7-dihydro-2H-[1,3]thiazolo[3,2-a][1,3,5]triazin-3(4H)-yl]benzoate
Smiles: CCOC(=O)c1ccc(cc1)N1CN=c2n(C1)c(=O)/c(=C/c1ccc(cc1)[N+](=O)[O-])/s2

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Molecular Weight: 438.46
Empirical Formula: C21H18N4O5S

Physical State: Dry powder
Available Amount: 300 mg

Lipinsky:
logP: 2.385
Rotatable bonds: 2
H-donors: 0
H-acceptors: 5
PSA: 133
Number of rings: 4

     

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