COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL241818
Chemical Name: 5-bromo-2-{5-[(1Z)-2-cyano-3-(methylamino)-3-oxoprop-1-en-1-yl]furan-2-yl}benzoicacid
Smiles: CNC(=O)/C(=C\c1ccc(o1)c1ccc(cc1C(=O)O)Br)/C#N

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Molecular Weight: 375.18
Empirical Formula: C16H11BrN2O4

Physical State: Dry powder
Available Amount: 308 mg

Lipinsky:
logP: 2.481
Rotatable bonds: 5
H-donors: 2
H-acceptors: 4
PSA: 103
Number of rings: 2

     

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