COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK152036
Chemical Name: 4-[(E)-(3-{2-[(3,4-dimethylphenyl)amino]-2-oxoethyl}-2,4-dioxo-1,3-thiazolidin-5-ylidene)methyl]benzoicacid
Smiles: O=C(CN1C(=O)S/C(=C/c2ccc(cc2)C(=O)O)/C1=O)Nc1ccc(c(c1)C)C

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Molecular Weight: 410.45
Empirical Formula: C21H18N2O5S

Physical State: Dry powder
Available Amount: 138 mg

Lipinsky:
logP: 3.976
Rotatable bonds: 3
H-donors: 2
H-acceptors: 5
PSA: 129
Number of rings: 3

     

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