COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK112045
Chemical Name: 2-ethoxy-4-{[(2-ethyl-4-oxoquinazolin-3(4H)-yl)imino]methyl}phenyl1,3-benzodioxole-5-carboxylate
Smiles: CCOc1cc(ccc1OC(=O)c1ccc2c(c1)OCO2)/C=N/n1c(CC)nc2c(c1=O)cccc2

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Molecular Weight: 485.5
Empirical Formula: C27H23N3O6

Physical State: Dry powder
Available Amount: 155 mg

Lipinsky:
logP: 4.72
Rotatable bonds: 8
H-donors: 0
H-acceptors: 6
PSA: 99
Number of rings: 5

     

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