COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK949522
Chemical Name: ethyl2-({(2E)-3-[4-(benzyloxy)phenyl]-2-cyanoprop-2-enoyl}amino)-4,5-dimethylthiophene-3-carboxylate
Smiles: CCOC(=O)c1c(NC(=O)/C(=C/c2ccc(cc2)OCc2ccccc2)/C#N)sc(c1C)C

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Molecular Weight: 460.55
Empirical Formula: C26H24N2O4S

Physical State: Dry powder
Available Amount: 61 mg

Lipinsky:
logP: 7.847
Rotatable bonds: 5
H-donors: 1
H-acceptors: 4
PSA: 116
Number of rings: 3

     

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