COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK830719
Chemical Name: ethyl5,5-dimethyl-2-{[(4-nitrophenyl)acetyl]amino}-4,7-dihydro-5H-thieno[2,3-c]pyran-3-carboxylate
Smiles: CCOC(=O)c1c(NC(=O)Cc2ccc(cc2)[N+](=O)[O-])sc2c1CC(C)(C)OC2

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Molecular Weight: 418.47
Empirical Formula: C20H22N2O6S

Physical State: Dry powder
Available Amount: 355 mg

Lipinsky:
logP: 4.299
Rotatable bonds: 4
H-donors: 1
H-acceptors: 6
PSA: 138
Number of rings: 3

     

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