COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL057204
Chemical Name: 3-(4-bromophenyl)-8-[(diethylammonio)methyl]-4-oxo-4H-chromen-7-olate
Smiles: CC[NH+](Cc1c([O-])ccc2c1occ(c2=O)c1ccc(cc1)Br)CC

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Molecular Weight: 402.29
Empirical Formula: C20H20BrNO3

Physical State: Dry powder
Available Amount: 300 mg

Lipinsky:
logP: 4.73
Rotatable bonds: 4
H-donors: 1
H-acceptors: 3
PSA: 53
Number of rings: 3

     

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