COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK437085
Chemical Name: methyl2-({[4-bromo-1-(4-chlorobenzyl)-1H-pyrazol-3-yl]carbamothioyl}amino)-4-ethyl-5-methylthiophene-3-carboxylate
Smiles: COC(=O)c1c(NC(=S)Nc2nn(cc2Br)Cc2ccc(cc2)Cl)sc(c1CC)C

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Molecular Weight: 527.89
Empirical Formula: C20H20BrClN4O2S2

Physical State: Dry powder
Available Amount: 360 mg

Lipinsky:
logP: 7.066
Rotatable bonds: 4
H-donors: 2
H-acceptors: 2
PSA: 128
Number of rings: 3

     

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