COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK558440
Chemical Name: ethyl4-[({[(5-{[(4,6-dimethylpyrimidin-2-yl)sulfanyl]methyl}-4-phenyl-4H-1,2,4-triazol-3-yl)sulfanyl]acetyl}amino)methyl]benzoate
Smiles: CCOC(=O)c1ccc(cc1)CNC(=O)CSc1nnc(n1c1ccccc1)CSc1nc(C)cc(n1)C

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Molecular Weight: 548.69
Empirical Formula: C27H28N6O3S2

Physical State: Dry powder
Available Amount: 300 mg

Lipinsky:
logP: 5.988
Rotatable bonds: 8
H-donors: 1
H-acceptors: 3
PSA: 162
Number of rings: 4

     

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