COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK533663
Chemical Name: N-(2-hydroxy-5-nitrophenyl)-4-[(5Z)-4-oxo-5-(thiophen-2-ylmethylidene)-2-thioxo-1,3-thiazolidin-3-yl]butanamide
Smiles: O=C(Nc1cc(ccc1O)[N+](=O)[O-])CCCN1C(=S)S/C(=C\c2cccs2)/C1=O

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Molecular Weight: 449.53
Empirical Formula: C18H15N3O5S3

Physical State: Dry powder
Available Amount: 349 mg

Lipinsky:
logP: 3.458
Rotatable bonds: 6
H-donors: 2
H-acceptors: 5
PSA: 201
Number of rings: 3

     

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