COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL321648
Chemical Name: ethyl(2Z)-cyano(1-methylazepan-2-ylidene)ethanoate
Smiles: CCOC(=O)/C(=C\1/CCCCCN1C)/C#N

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Molecular Weight: 222.29
Empirical Formula: C12H18N2O2

Physical State: Dry powder
Available Amount: 55 mg

Lipinsky:
logP: 2.054
Rotatable bonds: 3
H-donors: 0
H-acceptors: 2
PSA: 53
Number of rings: 1

     

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