COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK024148
Chemical Name: 4-(3,3,6,6-tetramethyl-1,8-dioxo-2,3,4,5,6,7,8,9-octahydro-1H-xanthen-9-yl)phenyl3,4-dichlorobenzoate
Smiles: O=C(c1ccc(c(c1)Cl)Cl)Oc1ccc(cc1)C1C2=C(OC3=C1C(=O)CC(C3)(C)C)CC(CC2=O)(C)C

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Molecular Weight: 539.45
Empirical Formula: C30H28Cl2O5

Physical State: Dry powder
Available Amount: 290 mg

Lipinsky:
logP: 6.962
Rotatable bonds: 2
H-donors: 0
H-acceptors: 5
PSA: 69
Number of rings: 5

     

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