COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK589226
Chemical Name: N-[2-(3,4-dihydroxyphenyl)-2-oxoethyl]-N-methyl-2-[(5Z)-4-oxo-5-(thiophen-2-ylmethylidene)-2-thioxo-1,3-thiazolidin-3-yl]acetamide
Smiles: O=C(N(CC(=O)c1ccc(c(c1)O)O)C)CN1C(=S)S/C(=C\c2cccs2)/C1=O

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Molecular Weight: 448.54
Empirical Formula: C19H16N2O5S3

Physical State: Dry powder
Available Amount: 300 mg

Lipinsky:
logP: 2.402
Rotatable bonds: 8
H-donors: 2
H-acceptors: 5
PSA: 183
Number of rings: 3

     

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