COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL400341
Chemical Name: 2-{[5-(4-bromothiophen-2-yl)-4-methyl-4H-1,2,4-triazol-3-yl]sulfanyl}-1-(4-chloro-1H-pyrazol-1-yl)ethanone
Smiles: Clc1cnn(c1)C(=O)CSc1nnc(n1C)c1scc(c1)Br

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Molecular Weight: 418.73
Empirical Formula: C12H9BrClN5OS2

Physical State: Dry powder
Available Amount: 45 mg

Lipinsky:
logP: 4.444
Rotatable bonds: 4
H-donors: 0
H-acceptors: 1
PSA: 119
Number of rings: 3

     

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