COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK531573
Chemical Name: 2-(dimethylamino)ethyl[(5Z)-5-(3-bromobenzylidene)-4-oxo-2-thioxo-1,3-thiazolidin-3-yl]acetate
Smiles: CN(CCOC(=O)CN1C(=S)S/C(=C\c2cccc(c2)Br)/C1=O)C

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Saltdata: HCl
Molecular Weight: 429.36
Empirical Formula: C16H17BrN2O3S2

Physical State: Dry powder
Available Amount: 350 mg

Lipinsky:
logP: 3.125
Rotatable bonds: 6
H-donors: 0
H-acceptors: 3
PSA: 107
Number of rings: 2

     

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