COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK925997
Chemical Name: N-(2-bromo-4-nitrophenyl)-2-{[4-(4-methylphenyl)-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}acetamide
Smiles: Cc1ccc(cc1)n1c2nnc(n2c2c(c1=O)c1CCCCc1s2)SCC(=O)Nc1ccc(cc1Br)[N+](=O)[O-]

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Molecular Weight: 625.53
Empirical Formula: C26H21BrN6O4S2

Physical State: Dry powder
Available Amount: 300 mg

Lipinsky:
logP: 7.564
Rotatable bonds: 3
H-donors: 1
H-acceptors: 4
PSA: 179
Number of rings: 6

     

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