COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK436964
Chemical Name: methyl2-({[4-bromo-1-(4-chlorobenzyl)-1H-pyrazol-3-yl]carbamothioyl}amino)-6-methyl-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxylate
Smiles: COC(=O)c1c(NC(=S)Nc2nn(cc2Br)Cc2ccc(cc2)Cl)sc2c1CCC(C2)C

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Molecular Weight: 553.93
Empirical Formula: C22H22BrClN4O2S2

Physical State: Dry powder
Available Amount: 200 mg

Lipinsky:
logP: 7.792
Rotatable bonds: 3
H-donors: 2
H-acceptors: 2
PSA: 128
Number of rings: 4

     

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