COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK483273
Chemical Name: 5-{[(2Z)-3-(5-bromo-2-ethoxyphenyl)-2-cyanoprop-2-enoyl]amino}-4-cyano-N,N,3-trimethylthiophene-2-carboxamide
Smiles: CCOc1ccc(cc1/C=C(\C(=O)Nc1sc(c(c1C#N)C)C(=O)N(C)C)/C#N)Br

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Molecular Weight: 487.38
Empirical Formula: C21H19BrN4O3S

Physical State: Dry powder
Available Amount: 241 mg

Lipinsky:
logP: 4.787
Rotatable bonds: 5
H-donors: 1
H-acceptors: 3
PSA: 134
Number of rings: 2

     

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