COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL045145
Chemical Name: (5E)-5-{[5-(2-bromo-4-nitrophenyl)furan-2-yl]methylidene}-2-sulfanyl-1,3-thiazol-4(5H)-one
Smiles: SC1=NC(=O)/C(=C\c2ccc(o2)c2ccc(cc2Br)[N+](=O)[O-])/S1

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Molecular Weight: 411.26
Empirical Formula: C14H7BrN2O4S2

Physical State: Dry powder
Available Amount: 300 mg

Lipinsky:
logP: 4.786
Rotatable bonds: 3
H-donors: 0
H-acceptors: 4
PSA: 152
Number of rings: 3

     

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