COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK847089
Chemical Name: 2-[5-(butoxymethyl)-2-oxotetrahydrofuran-3-yl]-N-[(4-nitrophenyl)carbamothioyl]acetamide(non-preferredname)
Smiles: CCCCOCC1CC(C(=O)O1)CC(=O)NC(=S)Nc1ccc(cc1)[N+](=O)[O-]

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Molecular Weight: 409.46
Empirical Formula: C18H23N3O6S

Physical State: Dry powder
Available Amount: 300 mg

Lipinsky:
logP: 1.798
Rotatable bonds: 7
H-donors: 2
H-acceptors: 6
PSA: 154
Number of rings: 2

     

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