COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK810416
Chemical Name: methyl(2Z)-5-[4-(acetyloxy)-3-methoxyphenyl]-2-{[3-(4-ethoxy-3-nitrophenyl)-1-phenyl-1H-pyrazol-4-yl]methylidene}-7-methyl-3-oxo-2,3-dihydro-5H-[1,3]thiazolo[3,2-a]pyrimidine-6-carboxylate
Smiles: CCOc1ccc(cc1[N+](=O)[O-])c1nn(cc1/C=c/1\sc2=NC(=C(C(n2c1=O)c1ccc(c(c1)OC)OC(=O)C)C(=O)OC)C)c1ccccc1

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Molecular Weight: 709.74
Empirical Formula: C36H31N5O9S

Physical State: Dry powder
Available Amount: 90 mg

Lipinsky:
logP: 5.973
Rotatable bonds: 10
H-donors: 0
H-acceptors: 9
PSA: 192
Number of rings: 6

     

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