COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL035407
Chemical Name: N-(4-nitrophenyl)-6-[(5E)-4-oxo-5-(thiophen-2-ylmethylidene)-2-thioxo-1,3-thiazolidin-3-yl]hexanamide
Smiles: O=C(Nc1ccc(cc1)[N+](=O)[O-])CCCCCN1C(=S)S/C(=C/c2cccs2)/C1=O

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Molecular Weight: 461.59
Empirical Formula: C20H19N3O4S3

Physical State: Dry powder
Available Amount: 50 mg

Lipinsky:
logP: 4.182
Rotatable bonds: 7
H-donors: 1
H-acceptors: 4
PSA: 180
Number of rings: 3

     

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