COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL378684
Chemical Name: (4-{(Z)-[4-(ethoxycarbonyl)-3-oxo-5-(phenylamino)thiophen-2(3H)-ylidene]methyl}phenoxy)aceticacid
Smiles: CCOC(=O)C1=C(Nc2ccccc2)S/C(=C\c2ccc(cc2)OCC(=O)O)/C1=O

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Molecular Weight: 425.46
Empirical Formula: C22H19NO6S

Physical State: Dry powder
Available Amount: 708 mg

Lipinsky:
logP: 3.973
Rotatable bonds: 6
H-donors: 2
H-acceptors: 6
PSA: 127
Number of rings: 3

     

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