COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL035404
Chemical Name: N-(2-hydroxy-4-nitrophenyl)-6-[(5E)-4-oxo-5-(thiophen-2-ylmethylidene)-2-thioxo-1,3-thiazolidin-3-yl]hexanamide
Smiles: O=C(Nc1ccc(cc1O)[N+](=O)[O-])CCCCCN1C(=S)S/C(=C/c2cccs2)/C1=O

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Molecular Weight: 477.59
Empirical Formula: C20H19N3O5S3

Physical State: Dry powder
Available Amount: 62 mg

Lipinsky:
logP: 4.535
Rotatable bonds: 8
H-donors: 2
H-acceptors: 5
PSA: 201
Number of rings: 3

     

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