COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL576294
Chemical Name: 2-oxo-2-(2,4,6-trimethylphenyl)ethylthiocyanate
Smiles: N#CSCC(=O)c1c(C)cc(cc1C)C

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Molecular Weight: 219.31
Empirical Formula: C12H13NOS

Physical State: Dry powder
Available Amount: 3 mg

Lipinsky:
logP: 3.294
Rotatable bonds: 2
H-donors: 0
H-acceptors: 1
PSA: 66
Number of rings: 1

     

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