COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK526550
Chemical Name: 4-(4-methylphenyl)-1-[(2-methylprop-2-en-1-yl)sulfanyl]-7,8-dihydro-6H-cyclopenta[4,5]thieno[3,2-e][1,2,4]triazolo[4,3-a]pyrimidin-5(4H)-one
Smiles: CC(=C)CSc1nnc2n1c1sc3c(c1c(=O)n2c1ccc(cc1)C)CCC3

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Molecular Weight: 408.55
Empirical Formula: C21H20N4OS2

Physical State: Dry powder
Available Amount: 300 mg

Lipinsky:
logP: 6.74
Rotatable bonds: 3
H-donors: 0
H-acceptors: 1
PSA: 104
Number of rings: 5

     

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