COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL443328
Chemical Name: methyl4-[(Z)-(3-{[(4-bromo-2-methylphenyl)amino]methyl}-2,4-dioxo-1,3-thiazolidin-5-ylidene)methyl]benzoate
Smiles: COC(=O)c1ccc(cc1)/C=C/1\SC(=O)N(C1=O)CNc1ccc(cc1C)Br

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Molecular Weight: 461.34
Empirical Formula: C20H17BrN2O4S

Physical State: Dry powder
Available Amount: 195 mg

Lipinsky:
logP: 5.191
Rotatable bonds: 3
H-donors: 1
H-acceptors: 4
PSA: 101
Number of rings: 3

     

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