COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK015248
Chemical Name: ethyl[(7,7-dimethyl-5-oxo-4-phenyl-4,5,6,9-tetrahydro-7H-pyrano[4',3':4,5]thieno[3,2-e][1,2,4]triazolo[4,3-a]pyrimidin-1-yl)sulfanyl]acetate
Smiles: CCOC(=O)CSc1nnc2n1c1sc3c(c1c(=O)n2c1ccccc1)CC(OC3)(C)C

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Molecular Weight: 470.57
Empirical Formula: C22H22N4O4S2

Physical State: Dry powder
Available Amount: 319 mg

Lipinsky:
logP: 5.286
Rotatable bonds: 5
H-donors: 0
H-acceptors: 4
PSA: 140
Number of rings: 5

     

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