COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK124486
Chemical Name: [(5E)-5-{[1-(3-bromophenyl)-1H-pyrrol-2-yl]methylidene}-4-oxo-2-thioxo-1,3-thiazolidin-3-yl]aceticacid
Smiles: OC(=O)CN1C(=S)S/C(=C/c2cccn2c2cccc(c2)Br)/C1=O

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Molecular Weight: 423.31
Empirical Formula: C16H11BrN2O3S2

Physical State: Dry powder
Available Amount: 181 mg

Lipinsky:
logP: 3.309
Rotatable bonds: 4
H-donors: 1
H-acceptors: 3
PSA: 119
Number of rings: 3

     

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