COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK674874
Chemical Name: 2-[5-(3,3,6,6-tetramethyl-1,8-dioxo-2,3,4,5,6,7,8,9-octahydro-1H-xanthen-9-yl)furan-2-yl]benzoicacid
Smiles: O=C1CC(C)(C)CC2=C1C(c1ccc(o1)c1ccccc1C(=O)O)C1=C(O2)CC(CC1=O)(C)C

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Saltdata: AcOH(3:1)
Molecular Weight: 460.53
Empirical Formula: C28H28O6

Physical State: Dry powder
Available Amount: 49 mg

Lipinsky:
logP: 4.126
Rotatable bonds: 4
H-donors: 1
H-acceptors: 6
PSA: 93
Number of rings: 5

     

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