COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL115179
Chemical Name: (2E,9E)-9-(4-ethoxybenzylidene)-5-(4-ethoxyphenyl)-2-(2-nitrobenzylidene)-6,7,8,9-tetrahydro-5H-[1,3]thiazolo[2,3-b]quinazolin-3(2H)-one
Smiles: CCOc1ccc(cc1)/C=C/1\CCCC2=C1N=c1s/c(=C/c3ccccc3[N+](=O)[O-])/c(=O)n1C2c1ccc(cc1)OCC

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Molecular Weight: 593.7
Empirical Formula: C34H31N3O5S

Physical State: Dry powder
Available Amount: 52 mg

Lipinsky:
logP: 7.794
Rotatable bonds: 3
H-donors: 0
H-acceptors: 5
PSA: 122
Number of rings: 6

     

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