COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK473596
Chemical Name: 4-[(1Z)-2-cyano-3-oxo-3-(1,3-thiazol-2-ylamino)prop-1-en-1-yl]-2-ethoxyphenyl4-chlorobenzoate
Smiles: CCOc1cc(ccc1OC(=O)c1ccc(cc1)Cl)/C=C(\C(=O)Nc1nccs1)/C#N

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Molecular Weight: 453.91
Empirical Formula: C22H16ClN3O4S

Physical State: Dry powder
Available Amount: 189 mg

Lipinsky:
logP: 5.23
Rotatable bonds: 6
H-donors: 1
H-acceptors: 4
PSA: 129
Number of rings: 3

     

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