COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK798378
Chemical Name: methyl(2E)-2-{[3-(4-ethoxy-3-nitrophenyl)-1-phenyl-1H-pyrazol-4-yl]methylidene}-7-methyl-3-oxo-5-(thiophen-2-yl)-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)c1cccs1)C(=O)OC)C)c1ccccc1

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Molecular Weight: 627.7
Empirical Formula: C31H25N5O6S2

Physical State: Dry powder
Available Amount: 107 mg

Lipinsky:
logP: 6.49
Rotatable bonds: 7
H-donors: 0
H-acceptors: 6
PSA: 185
Number of rings: 6

     

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