COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK810102
Chemical Name: 2-methylpropyl(2Z)-5-[4-(acetyloxy)-3-ethoxyphenyl]-7-methyl-2-(4-nitrobenzylidene)-3-oxo-2,3-dihydro-5H-[1,3]thiazolo[3,2-a]pyrimidine-6-carboxylate
Smiles: CCOc1cc(ccc1OC(=O)C)C1C(=C(C)N=c2n1c(=O)/c(=C/c1ccc(cc1)[N+](=O)[O-])/s2)C(=O)OCC(C)C

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Molecular Weight: 579.63
Empirical Formula: C29H29N3O8S

Physical State: Dry powder
Available Amount: 104 mg

Lipinsky:
logP: 5.895
Rotatable bonds: 9
H-donors: 0
H-acceptors: 8
PSA: 165
Number of rings: 4

     

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