COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK918427
Chemical Name: butyl4-({[(5Z)-4-oxo-5-(thiophen-2-ylmethylidene)-2-thioxo-1,3-thiazolidin-3-yl]acetyl}amino)benzoate
Smiles: CCCCOC(=O)c1ccc(cc1)NC(=O)CN1C(=S)S/C(=C\c2cccs2)/C1=O

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Molecular Weight: 460.6
Empirical Formula: C21H20N2O4S3

Physical State: Dry powder
Available Amount: 50 mg

Lipinsky:
logP: 5.16
Rotatable bonds: 7
H-donors: 1
H-acceptors: 4
PSA: 161
Number of rings: 3

     

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