COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: BBL027712
Chemical Name: dimethyl2-acetylbutanedioate
Smiles: COC(=O)CC(C(=O)OC)C(=O)C

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Molecular Weight: 188.18
Empirical Formula: C8H12O5

Physical State: Dry powder
Available Amount: 1000 mg

Lipinsky:
logP: 0.627
Rotatable bonds: 6
H-donors: 0
H-acceptors: 5
PSA: 69
Number of rings: 0

     

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