COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK799127
Chemical Name: prop-2-en-1-yl(2Z)-5-(4-methoxyphenyl)-7-methyl-3-oxo-2-{[1-phenyl-3-(4-propoxyphenyl)-1H-pyrazol-4-yl]methylidene}-2,3-dihydro-5H-[1,3]thiazolo[3,2-a]pyrimidine-6-carboxylate
Smiles: CCCOc1ccc(cc1)c1nn(cc1/C=c/1\sc2=NC(=C(C(n2c1=O)c1ccc(cc1)OC)C(=O)OCC=C)C)c1ccccc1

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Saltdata: 1/4CH3COOH
Molecular Weight: 646.77
Empirical Formula: C37H34N4O5S

Physical State: Dry powder
Available Amount: 100 mg

Lipinsky:
logP: 8.615
Rotatable bonds: 7
H-donors: 0
H-acceptors: 5
PSA: 120
Number of rings: 6

     

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