COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK528599
Chemical Name: 2,2'-{[4-(2-chloroethyl)phenyl]methanediyl}bis(5,5-dimethylcyclohexane-1,3-dione)
Smiles: ClCCc1ccc(cc1)C(C1C(=O)CC(CC1=O)(C)C)C1C(=O)CC(CC1=O)(C)C

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Molecular Weight: 430.97
Empirical Formula: C25H31ClO4

Physical State: Dry powder
Available Amount: 300 mg

Lipinsky:
logP: 3.652
Rotatable bonds: 3
H-donors: 0
H-acceptors: 4
PSA: 68
Number of rings: 3

     

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