COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL092806
Chemical Name: ethyl10-ethoxy-3-(3-methoxypropyl)-2-methyl-4-thioxo-3,4,5,6-tetrahydro-2H-2,6-methano-1,3,5-benzoxadiazocine-11-carboxylate
Smiles: COCCCN1C(=S)NC2C(C1(C)Oc1c2cccc1OCC)C(=O)OCC

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Molecular Weight: 408.52
Empirical Formula: C20H28N2O5S

Physical State: Dry powder
Available Amount: 40 mg

Lipinsky:
logP: 3.095
Rotatable bonds: 9
H-donors: 1
H-acceptors: 5
PSA: 101
Number of rings: 3

     

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