COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL326535
Chemical Name: S-[(2E)-3,3-dimethyl-2-{2-[(4-nitrophenyl)carbonyl]hydrazinylidene}butyl]O,O-diethylphosphorodithioate
Smiles: CCOP(=S)(SC/C(=N/NC(=O)c1ccc(cc1)[N+](=O)[O-])/C(C)(C)C)OCC

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Molecular Weight: 447.52
Empirical Formula: C17H26N3O5PS2

Available Amount: 0 mg

Lipinsky:
logP: 4.892
Rotatable bonds: 8
H-donors: 1
H-acceptors: 5
PSA: 172
Number of rings: 1

     

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