COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK553212
Chemical Name: 2-{[6-ethyl-6-methyl-2-(methylsulfanyl)-5,8-dihydro-6H-pyrano[4',3':4,5]thieno[2,3-d]pyrimidin-4-yl]sulfanyl}-1-(4-fluorophenyl)ethanone
Smiles: CCC1(C)OCc2c(C1)c1c(SCC(=O)c3ccc(cc3)F)nc(nc1s2)SC

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Molecular Weight: 448.61
Empirical Formula: C21H21FN2O2S3

Physical State: Dry powder
Available Amount: 313 mg

Lipinsky:
logP: 6.995
Rotatable bonds: 5
H-donors: 0
H-acceptors: 2
PSA: 130
Number of rings: 4

     

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