COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK525204
Chemical Name: 2',4,5',6-tetra-tert-butyl-3'-hydroxy-4'H-spiro[1,3-benzodioxole-2,1'-cyclohexa[2,5]dien]-4'-one
Smiles: O=C1C(=C(C(C)(C)C)C2(C=C1C(C)(C)C)Oc1c(O2)cc(cc1C(C)(C)C)C(C)(C)C)O

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Molecular Weight: 440.62
Empirical Formula: C28H40O4

Physical State: Dry powder
Available Amount: 244 mg

Lipinsky:
logP: 9.567
Rotatable bonds: 1
H-donors: 1
H-acceptors: 4
PSA: 55
Number of rings: 3

     

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