COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK071924
Chemical Name: [(5Z)-5-(3-methoxy-4-{[(4-nitrophenyl)carbonyl]oxy}benzylidene)-4-oxo-2-thioxo-1,3-thiazolidin-3-yl]aceticacid
Smiles: COc1cc(ccc1OC(=O)c1ccc(cc1)[N+](=O)[O-])/C=C/1\SC(=S)N(C1=O)CC(=O)O

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Molecular Weight: 474.47
Empirical Formula: C20H14N2O8S2

Physical State: Dry powder
Available Amount: 89 mg

Lipinsky:
logP: 2.996
Rotatable bonds: 7
H-donors: 1
H-acceptors: 8
PSA: 196
Number of rings: 3

     

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