COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK698947
Chemical Name: 2-{[5-(methylsulfanyl)-9,10-dihydro-8H-cyclopenta[4,5]thieno[3,2-e][1,2,4]triazolo[4,3-c]pyrimidin-3-yl]sulfanyl}-1-phenylethanone
Smiles: CSc1nc2sc3c(c2c2n1c(SCC(=O)c1ccccc1)nn2)CCC3

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Molecular Weight: 412.56
Empirical Formula: C19H16N4OS3

Physical State: Dry powder
Available Amount: 300 mg

Lipinsky:
logP: 6.89
Rotatable bonds: 4
H-donors: 0
H-acceptors: 1
PSA: 138
Number of rings: 5

     

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