COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK851517
Chemical Name: 3-(3,5-dimethylphenoxy)-4-oxo-8-(piperidinium-1-ylmethyl)-2-(trifluoromethyl)-4H-chromen-7-olate
Smiles: Cc1cc(cc(c1)C)Oc1c(=O)c2ccc(c(c2oc1C(F)(F)F)C[NH+]1CCCCC1)[O-]

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Molecular Weight: 447.45
Empirical Formula: C24H24F3NO4

Physical State: Dry powder
Available Amount: 157 mg

Lipinsky:
logP: 7.195
Rotatable bonds: 3
H-donors: 1
H-acceptors: 4
PSA: 63
Number of rings: 4

     

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