COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL037625
Chemical Name: 8-tert-butyl-4-(4-methylphenyl)-1-thioxo-2,4,6,7,8,9-hexahydro[1]benzothieno[3,2-e][1,2,4]triazolo[4,3-a]pyrimidin-5(1H)-one
Smiles: Cc1ccc(cc1)n1c(=O)c2c3CCC(Cc3sc2n2c1n[nH]c2=S)C(C)(C)C

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Molecular Weight: 424.59
Empirical Formula: C22H24N4OS2

Physical State: Dry powder
Available Amount: 324 mg

Lipinsky:
logP: 5.656
Rotatable bonds: 0
H-donors: 1
H-acceptors: 1
PSA: 108
Number of rings: 5

     

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