COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL049129
Chemical Name: N-(4-ethoxy-2-nitrophenyl)-8-oxo-1,5,6,8-tetrahydro-2H-1,5-methanopyrido[1,2-a][1,5]diazocine-3(4H)-carbothioamide
Smiles: CCOc1ccc(c(c1)[N+](=O)[O-])NC(=S)N1CC2CC(C1)c1n(C2)c(=O)ccc1

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Molecular Weight: 414.49
Empirical Formula: C20H22N4O4S

Physical State: Dry powder
Available Amount: 300 mg

Lipinsky:
logP: 2.218
Rotatable bonds: 2
H-donors: 1
H-acceptors: 4
PSA: 122
Number of rings: 4

     

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