COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK028323
Chemical Name: 4-(7-tert-butyl-4-oxo-3,4,5,6,7,8-hexahydro[1]benzothieno[2,3-d]pyrimidin-2-yl)-2-ethoxyphenyl4-methylbenzenesulfonate
Smiles: CCOc1cc(ccc1OS(=O)(=O)c1ccc(cc1)C)c1nc2sc3c(c2c(=O)[nH]1)CCC(C3)C(C)(C)C

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Molecular Weight: 552.72
Empirical Formula: C29H32N2O5S2

Physical State: Dry powder
Available Amount: 440 mg

Lipinsky:
logP: 6.947
Rotatable bonds: 5
H-donors: 1
H-acceptors: 5
PSA: 130
Number of rings: 5

     

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