COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK200258
Chemical Name: ethyl4-cyano-5-{[(E)-(5-hydroxy-3-methyl-1-phenyl-1H-pyrazol-4-yl)methylidene]amino}-3-methylthiophene-2-carboxylate
Smiles: CCOC(=O)c1sc(c(c1C)C#N)/N=C/c1c(C)nn(c1O)c1ccccc1

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Saltdata: HCl
Molecular Weight: 394.45
Empirical Formula: C20H18N4O3S

Physical State: Dry powder
Available Amount: 301 mg

Lipinsky:
logP: 5.402
Rotatable bonds: 5
H-donors: 1
H-acceptors: 3
PSA: 128
Number of rings: 3

     

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