COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK670838
Chemical Name: 3,3',5,5'-tetra-tert-butyl-3,3'-dichloro-1,1'-bi(cyclohexa-1,5-dien-1-yl)-4,4'-dione
Smiles: O=C1C(=CC(=CC1(Cl)C(C)(C)C)C1=CC(C(=O)C(=C1)C(C)(C)C)(Cl)C(C)(C)C)C(C)(C)C

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Molecular Weight: 479.53
Empirical Formula: C28H40Cl2O2

Physical State: Dry powder
Available Amount: 2 mg

Lipinsky:
logP: 6.725
Rotatable bonds: 1
H-donors: 0
H-acceptors: 2
PSA: 34
Number of rings: 2

     

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