COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK198822
Chemical Name: 4-{[4-(1,8-dioxo-2,3,4,5,6,7,8,9-octahydro-1H-xanthen-9-yl)-2-ethoxyphenoxy]methyl}benzoicacid
Smiles: CCOc1cc(ccc1OCc1ccc(cc1)C(=O)O)C1C2=C(CCCC2=O)OC2=C1C(=O)CCC2

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Molecular Weight: 488.54
Empirical Formula: C29H28O7

Physical State: Dry powder
Available Amount: 94 mg

Lipinsky:
logP: 3.689
Rotatable bonds: 6
H-donors: 1
H-acceptors: 7
PSA: 99
Number of rings: 5

     

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