COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL374716
Chemical Name: (2-{(Z)-[4-(ethoxycarbonyl)-5-[(4-methylphenyl)amino]-3-oxothiophen-2(3H)-ylidene]methyl}phenoxy)aceticacid
Smiles: CCOC(=O)C1=C(Nc2ccc(cc2)C)S/C(=C\c2ccccc2OCC(=O)O)/C1=O

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Molecular Weight: 439.49
Empirical Formula: C23H21NO6S

Physical State: Dry powder
Available Amount: 500 mg

Lipinsky:
logP: 4.493
Rotatable bonds: 8
H-donors: 2
H-acceptors: 6
PSA: 127
Number of rings: 3

     

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