COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK458393
Chemical Name: dimethyl5-({[4-bromo-1-(3,4-dichlorobenzyl)-1H-pyrazol-3-yl]carbamothioyl}amino)-3-methylthiophene-2,4-dicarboxylate
Smiles: COC(=O)c1c(NC(=S)Nc2nn(cc2Br)Cc2ccc(c(c2)Cl)Cl)sc(c1C)C(=O)OC

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Molecular Weight: 592.32
Empirical Formula: C20H17BrCl2N4O4S2

Physical State: Dry powder
Available Amount: 62 mg

Lipinsky:
logP: 7.072
Rotatable bonds: 6
H-donors: 2
H-acceptors: 4
PSA: 154
Number of rings: 3

     

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