COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK456843
Chemical Name: methyl2-{[(4-bromo-2-ethylphenyl)carbamothioyl]amino}-5-methyl-4-phenylthiophene-3-carboxylate
Smiles: COC(=O)c1c(NC(=S)Nc2ccc(cc2CC)Br)sc(c1c1ccccc1)C

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Molecular Weight: 489.46
Empirical Formula: C22H21BrN2O2S2

Physical State: Dry powder
Available Amount: 636 mg

Lipinsky:
logP: 7.825
Rotatable bonds: 3
H-donors: 2
H-acceptors: 2
PSA: 110
Number of rings: 3

     

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