COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL433099
Chemical Name: methyl3-(cyanomethyl)benzoate
Smiles: N#CCc1cccc(c1)C(=O)OC

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Molecular Weight: 175.19
Empirical Formula: C10H9NO2

Physical State: Dry powder
Available Amount: 55 mg

Lipinsky:
logP: 1.427
Rotatable bonds: 3
H-donors: 0
H-acceptors: 2
PSA: 50
Number of rings: 1

     

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