COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK969680
Chemical Name: 6-[(5Z)-5-(4-chloro-3-nitrobenzylidene)-4-oxo-2-thioxo-1,3-thiazolidin-3-yl]hexanoicacid
Smiles: OC(=O)CCCCCN1C(=S)S/C(=C\c2ccc(c(c2)[N+](=O)[O-])Cl)/C1=O

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Molecular Weight: 414.89
Empirical Formula: C16H15ClN2O5S2

Physical State: Dry powder
Available Amount: 210 mg

Lipinsky:
logP: 2.639
Rotatable bonds: 8
H-donors: 1
H-acceptors: 5
PSA: 160
Number of rings: 2

     

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