COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK555632
Chemical Name: 2-{[4-(4-chlorophenyl)-7-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}-N-(3-methylphenyl)acetamide
Smiles: CC1CCc2c(C1)c1c(s2)n2c(SCC(=O)Nc3cccc(c3)C)nnc2n(c1=O)c1ccc(cc1)Cl

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Molecular Weight: 550.1
Empirical Formula: C27H24ClN5O2S2

Physical State: Dry powder
Available Amount: 300 mg

Lipinsky:
logP: 8.018
Rotatable bonds: 3
H-donors: 1
H-acceptors: 2
PSA: 133
Number of rings: 6

     

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