COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK022727
Chemical Name: 2-{[2-ethoxy-4-(4-oxo-3,4,5,6,7,8-hexahydro[1]benzothieno[2,3-d]pyrimidin-2-yl)phenoxy]methyl}benzonitrile
Smiles: CCOc1cc(ccc1OCc1ccccc1C#N)c1nc2sc3c(c2c(=O)[nH]1)CCCC3

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Molecular Weight: 457.55
Empirical Formula: C26H23N3O3S

Physical State: Dry powder
Available Amount: 197 mg

Lipinsky:
logP: 5.189
Rotatable bonds: 6
H-donors: 1
H-acceptors: 3
PSA: 111
Number of rings: 5

     

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