COMPOUNDS FOR BIOLOGICAL SCREENING
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Vitas-M Lab ID: STL058840
Chemical Name: 2-cyano-3,3-dimethyl-4-oxopentanoate
Smiles: N#CC(C(C(=O)C)(C)C)C(=O)[O-]

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Saltdata: Na+
Molecular Weight: 168.17
Empirical Formula: C8H10NO3

Physical State: Dry powder
Available Amount: 145 mg

Lipinsky:
logP: 0.395
Rotatable bonds: 2
H-donors: 0
H-acceptors: 3
PSA: 80
Number of rings: 0

     

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