COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL057127
Chemical Name: 3-(2-bromophenoxy)-8-{[4-(2-hydroxyethyl)piperazin-1-ium-1-yl]methyl}-4-oxo-4H-chromen-7-olate
Smiles: OCCN1CC[NH+](CC1)Cc1c([O-])ccc2c1occ(c2=O)Oc1ccccc1Br

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Molecular Weight: 475.34
Empirical Formula: C22H23BrN2O5

Physical State: Dry powder
Available Amount: 310 mg

Lipinsky:
logP: 2.516
Rotatable bonds: 6
H-donors: 2
H-acceptors: 5
PSA: 86
Number of rings: 4

     

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