COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK427066
Chemical Name: ethyl5-acetyl-2-({[2-(3,4-dimethylphenyl)quinolin-4-yl]carbonyl}amino)-4-methylthiophene-3-carboxylate
Smiles: CCOC(=O)c1c(NC(=O)c2cc(nc3c2cccc3)c2ccc(c(c2)C)C)sc(c1C)C(=O)C

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Molecular Weight: 486.59
Empirical Formula: C28H26N2O4S

Physical State: Dry powder
Available Amount: 789 mg

Lipinsky:
logP: 7.836
Rotatable bonds: 6
H-donors: 1
H-acceptors: 4
PSA: 113
Number of rings: 4

     

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