COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK434844
Chemical Name: methyl2-({(2E)-3-[4-(acetyloxy)-3-ethoxyphenyl]-2-cyanoprop-2-enoyl}amino)-5-(dimethylcarbamoyl)-4-methylthiophene-3-carboxylate
Smiles: CCOc1cc(ccc1OC(=O)C)/C=C(/C(=O)Nc1sc(c(c1C(=O)OC)C)C(=O)N(C)C)\C#N

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Molecular Weight: 499.54
Empirical Formula: C24H25N3O7S

Physical State: Dry powder
Available Amount: 540 mg

Lipinsky:
logP: 4.59
Rotatable bonds: 9
H-donors: 1
H-acceptors: 7
PSA: 163
Number of rings: 2

     

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