COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL418910
Chemical Name: 2-chloro-5-(5-{(E)-[3-(4-nitrophenyl)-4-oxo-2-thioxo-1,3-thiazolidin-5-ylidene]methyl}furan-2-yl)benzoicacid
Smiles: S=C1S/C(=C/c2ccc(o2)c2ccc(c(c2)C(=O)O)Cl)/C(=O)N1c1ccc(cc1)[N+](=O)[O-]

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Molecular Weight: 486.91
Empirical Formula: C21H11ClN2O6S2

Physical State: Dry powder
Available Amount: 126 mg

Lipinsky:
logP: 5.576
Rotatable bonds: 4
H-donors: 1
H-acceptors: 6
PSA: 173
Number of rings: 4

     

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