COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK039499
Chemical Name: N-(2-tert-butyl-6,6-dimethyl-4-oxo-5,8-dihydro-4H-pyrano[4',3':4,5]thieno[2,3-d]pyrimidin-3(6H)-yl)-4-nitrobenzamide
Smiles: O=C(c1ccc(cc1)[N+](=O)[O-])Nn1c(=O)c2c(nc1C(C)(C)C)sc1c2CC(C)(C)OC1

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Molecular Weight: 456.52
Empirical Formula: C22H24N4O5S

Physical State: Dry powder
Available Amount: 276 mg

Lipinsky:
logP: 3.407
Rotatable bonds: 1
H-donors: 1
H-acceptors: 5
PSA: 145
Number of rings: 4

     

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