COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL055121
Chemical Name: 3-(2,3-dihydro-1,4-benzodioxin-6-yl)-4-oxo-8-(pyrrolidinium-1-ylmethyl)-4H-chromen-7-olate
Smiles: [O-]c1ccc2c(c1C[NH+]1CCCC1)occ(c2=O)c1ccc2c(c1)OCCO2

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Molecular Weight: 379.41
Empirical Formula: C22H21NO5

Physical State: Dry powder
Available Amount: 318 mg

Lipinsky:
logP: 2.744
Rotatable bonds: 3
H-donors: 1
H-acceptors: 5
PSA: 72
Number of rings: 5

     

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