COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL051665
Chemical Name: 8-[(dimethylammonio)methyl]-4-oxo-3-[4-(propoxycarbonyl)phenoxy]-2-(trifluoromethyl)-4H-chromen-7-olate
Smiles: CCCOC(=O)c1ccc(cc1)Oc1c(=O)c2ccc(c(c2oc1C(F)(F)F)C[NH+](C)C)[O-]

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Molecular Weight: 465.43
Empirical Formula: C23H22F3NO6

Physical State: Dry powder
Available Amount: 310 mg

Lipinsky:
logP: 6.79
Rotatable bonds: 6
H-donors: 1
H-acceptors: 6
PSA: 89
Number of rings: 3

     

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