COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL371537
Chemical Name: (4-{(Z)-[4-(ethoxycarbonyl)-5-{[(4-methylphenyl)carbonyl]amino}-3-oxothiophen-2(3H)-ylidene]methyl}phenoxy)aceticacid
Smiles: CCOC(=O)C1=C(S/C(=C\c2ccc(cc2)OCC(=O)O)/C1=O)NC(=O)c1ccc(cc1)C

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Molecular Weight: 467.5
Empirical Formula: C24H21NO7S

Physical State: Dry powder
Available Amount: 713 mg

Lipinsky:
logP: 3.633
Rotatable bonds: 6
H-donors: 2
H-acceptors: 7
PSA: 144
Number of rings: 3

     

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