COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK541411
Chemical Name: S-{[5-oxo-4-(2-phenylethyl)-4,5,6,7,8,9-hexahydro[1]benzothieno[3,2-e][1,2,4]triazolo[4,3-a]pyrimidin-1-yl]methyl}methyl(phenyl)carbamothioate
Smiles: CN(c1ccccc1)C(=O)SCc1nnc2n1c1sc3c(c1c(=O)n2CCc1ccccc1)CCCC3

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Molecular Weight: 529.69
Empirical Formula: C28H27N5O2S2

Physical State: Dry powder
Available Amount: 300 mg

Lipinsky:
logP: 6.814
Rotatable bonds: 5
H-donors: 0
H-acceptors: 2
PSA: 124
Number of rings: 6

     

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