COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK533174
Chemical Name: 2-(dimethylamino)ethyl4-[(5Z)-4-oxo-5-(thiophen-2-ylmethylidene)-2-thioxo-1,3-thiazolidin-3-yl]butanoate
Smiles: CN(CCOC(=O)CCCN1C(=S)S/C(=C\c2cccs2)/C1=O)C

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Saltdata: HCl
Molecular Weight: 384.54
Empirical Formula: C16H20N2O3S3

Physical State: Dry powder
Available Amount: 354 mg

Lipinsky:
logP: 2.323
Rotatable bonds: 8
H-donors: 0
H-acceptors: 3
PSA: 135
Number of rings: 2

     

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