COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL040472
Chemical Name: 8-{[4-(2-hydroxyethyl)piperazin-1-ium-1-yl]methyl}-3-[4-(methoxycarbonyl)phenoxy]-4-oxo-2-(trifluoromethyl)-4H-chromen-7-olate
Smiles: OCCN1CC[NH+](CC1)Cc1c([O-])ccc2c1oc(c(c2=O)Oc1ccc(cc1)C(=O)OC)C(F)(F)F

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Molecular Weight: 522.48
Empirical Formula: C25H25F3N2O7

Physical State: Dry powder
Available Amount: 55 mg

Lipinsky:
logP: 4.403
Rotatable bonds: 6
H-donors: 2
H-acceptors: 7
PSA: 112
Number of rings: 4

     

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