COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL425608
Chemical Name: methyl3-[3-(difluoromethoxy)phenyl]-3-(3-hydroxy-1,4-dioxo-1,4-dihydronaphthalen-2-yl)propanoate
Smiles: COC(=O)CC(C1=C(O)C(=O)c2c(C1=O)cccc2)c1cccc(c1)OC(F)F

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Molecular Weight: 402.35
Empirical Formula: C21H16F2O6

Physical State: Dry powder
Available Amount: 300 mg

Lipinsky:
logP: 4.284
Rotatable bonds: 8
H-donors: 1
H-acceptors: 6
PSA: 89
Number of rings: 3

     

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