COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK852115
Chemical Name: 3-(4-tert-butylphenoxy)-4-oxo-8-(pyrrolidinium-1-ylmethyl)-2-(trifluoromethyl)-4H-chromen-7-olate
Smiles: [O-]c1ccc2c(c1C[NH+]1CCCC1)oc(c(c2=O)Oc1ccc(cc1)C(C)(C)C)C(F)(F)F

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Molecular Weight: 461.48
Empirical Formula: C25H26F3NO4

Physical State: Dry powder
Available Amount: 144 mg

Lipinsky:
logP: 7.399
Rotatable bonds: 3
H-donors: 1
H-acceptors: 4
PSA: 63
Number of rings: 4

     

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