COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK437088
Chemical Name: methyl2-({[1-(4-chlorobenzyl)-5-methyl-1H-pyrazol-3-yl]carbamothioyl}amino)-4-ethyl-5-methylthiophene-3-carboxylate
Smiles: COC(=O)c1c(NC(=S)Nc2nn(c(c2)C)Cc2ccc(cc2)Cl)sc(c1CC)C

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Molecular Weight: 463.02
Empirical Formula: C21H23ClN4O2S2

Physical State: Dry powder
Available Amount: 480 mg

Lipinsky:
logP: 6.49
Rotatable bonds: 4
H-donors: 2
H-acceptors: 2
PSA: 128
Number of rings: 3

     

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