COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL094435
Chemical Name: ethyl8-bromo-3-(4-ethoxyphenyl)-2-methyl-4-thioxo-3,4,5,6-tetrahydro-2H-2,6-methano-1,3,5-benzoxadiazocine-11-carboxylate
Smiles: CCOC(=O)C1C2NC(=S)N(C1(C)Oc1c2cc(Br)cc1)c1ccc(cc1)OCC

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Molecular Weight: 491.41
Empirical Formula: C22H23BrN2O4S

Physical State: Dry powder
Available Amount: 90 mg

Lipinsky:
logP: 5.814
Rotatable bonds: 4
H-donors: 1
H-acceptors: 4
PSA: 92
Number of rings: 4

     

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