COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK279074
Chemical Name: 2-(1,3-benzothiazol-2-ylsulfanyl)-3-(2-ethoxyphenyl)-3-hydroxypropanenitrile
Smiles: CCOc1ccccc1C(C(Sc1nc2c(s1)cccc2)C#N)O

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Molecular Weight: 356.47
Empirical Formula: C18H16N2O2S2

Physical State: Dry powder
Available Amount: 142 mg

Lipinsky:
logP: 5.276
Rotatable bonds: 7
H-donors: 1
H-acceptors: 2
PSA: 119
Number of rings: 3

     

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