COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK850125
Chemical Name: 8-[(dimethylammonio)methyl]-3-(3,5-dimethylphenoxy)-4-oxo-2-(trifluoromethyl)-4H-chromen-7-olate
Smiles: C[NH+](Cc1c([O-])ccc2c1oc(c(c2=O)Oc1cc(C)cc(c1)C)C(F)(F)F)C

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Molecular Weight: 407.39
Empirical Formula: C21H20F3NO4

Physical State: Dry powder
Available Amount: 199 mg

Lipinsky:
logP: 6.419
Rotatable bonds: 3
H-donors: 1
H-acceptors: 4
PSA: 63
Number of rings: 3

     

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