COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK994277
Chemical Name: 3-[(5Z)-5-(4-ethylbenzylidene)-4-oxo-2-thioxo-1,3-thiazolidin-3-yl]-N-(2-hydroxy-5-nitrophenyl)propanamide
Smiles: CCc1ccc(cc1)/C=C/1\SC(=S)N(C1=O)CCC(=O)Nc1cc(ccc1O)[N+](=O)[O-]

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Molecular Weight: 457.53
Empirical Formula: C21H19N3O5S2

Physical State: Dry powder
Available Amount: 52 mg

Lipinsky:
logP: 4.417
Rotatable bonds: 4
H-donors: 2
H-acceptors: 5
PSA: 172
Number of rings: 3

     

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