COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK530932
Chemical Name: {[4-(4-methoxyphenyl)-8-methyl-5-oxo-4,5,6,7,8,9-hexahydro[1]benzothieno[3,2-e][1,2,4]triazolo[4,3-a]pyrimidin-1-yl]sulfanyl}aceticacid
Smiles: COc1ccc(cc1)n1c2nnc(n2c2c(c1=O)c1CCC(Cc1s2)C)SCC(=O)O

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Molecular Weight: 456.55
Empirical Formula: C21H20N4O4S2

Physical State: Dry powder
Available Amount: 309 mg

Lipinsky:
logP: 5.51
Rotatable bonds: 4
H-donors: 1
H-acceptors: 4
PSA: 151
Number of rings: 5

     

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