COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK458246
Chemical Name: ethyl2-({[2-(4-bromo-1H-pyrazol-1-yl)ethyl]carbamothioyl}amino)-5-methyl-4-phenylthiophene-3-carboxylate
Smiles: CCOC(=O)c1c(NC(=S)NCCn2ncc(c2)Br)sc(c1c1ccccc1)C

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Molecular Weight: 493.45
Empirical Formula: C20H21BrN4O2S2

Physical State: Dry powder
Available Amount: 729 mg

Lipinsky:
logP: 6.129
Rotatable bonds: 6
H-donors: 2
H-acceptors: 2
PSA: 128
Number of rings: 3

     

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