COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: BBL028615
Chemical Name: (2-methyl-3-oxobutan-2-yl)propanedioicacid
Smiles: OC(=O)C(C(C(=O)C)(C)C)C(=O)O

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Molecular Weight: 188.18
Empirical Formula: C8H12O5

Physical State: Dry powder
Available Amount: 1006 mg

Lipinsky:
logP: 0.458
Rotatable bonds: 6
H-donors: 2
H-acceptors: 5
PSA: 91
Number of rings: 0

     

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